2-[bis(chloranyl)methyl]-4-(4-methylphenyl)-1H-1,5-benzodiazepine

Systemtic Name: 2-[bis(chloranyl)methyl]-4-(4-methylphenyl)-1H-1,5-benzodiazepine Openeye Name: 2-(dichloromethyl)-4-(p-tolyl)-1H-1,5-benzodiazepine CAS Name: 2-(dichloromethyl)-4-(4-methylphenyl)-1H-1,5-benzodiazepine IUPAC Name: 2-(dichloromethyl)-4-(4-methylphenyl)-1H-1,5-benzodiazepine Traditional Name: 2-(dichloromethyl)-4-(p-tolyl)-1H-1,5-benzodiazepine Formula: C17H14Cl2N2 MolecularWeight: 317.21246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=C2)C(Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=C2)C(Cl)Cl

InChI

InChI=1S/C17H14Cl2N2/c1-11-6-8-12(9-7-11)15-10-16(17(18)19)21-14-5-3-2-4-13(14)20-15/h2-10,17,21H,1H3