ISDA: 3WJ5

Atom Indices

Bond Indices

Highlight Substructure

Structural Complex

Chemical ID: T9T

IUPAC Name: chlorotri(phenyl)stannane

Formal Charge: ?

Type: NON-POLYMER

Substructure

Substruture Type: MurckoScaffold

SMILES: c1cc[c-](->[SnH](<-[c-]2ccccc2)<-[c-]2ccccc2)cc1

InChI: ?

InChI Key: ?

Physiochemical Descriptor:

Formula: C18 H15 Cl Sn

Molecular weight: 385.475

Hydrogen Bond Acceptor: 0

Hydrogen Bond Donor: 0

Rotatable Bonds: 0

Heavy Atoms: 20

Systematic name

Program	Version	Descriptor
ACDLabs	14.52	chlorotri(phenyl)stannane
OpenEye OEToolkits	3.1.0.0	chloranyl(triphenyl)stannane

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	14.52	Cl[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
InChI	InChI	1.06	InChI=1S/3C6H5.ClH.Sn/c31-2-4-6-5-3-1;;/h31-5H;1H;/q;;;;+1/p-1
InChIKey	InChI	1.06	NJVOZLGKTAPUTQ-UHFFFAOYSA-M
SMILES_CANONICAL	CACTVS	3.385	Cl[Sn](c1ccccc1)(c2ccccc2)c3ccccc3
SMILES	CACTVS	3.385	Cl[Sn](c1ccccc1)(c2ccccc2)c3ccccc3
SMILES_CANONICAL	OpenEye OEToolkits	3.1.0.0	c1ccc(cc1)[Sn](c2ccccc2)(c3ccccc3)Cl
SMILES	OpenEye OEToolkits	3.1.0.0	c1ccc(cc1)[Sn](c2ccccc2)(c3ccccc3)Cl

Chemical Database Mapping

Database	Reference ID
PubChem	138398275,5357402
SureChEMBL	124009