5-(4-chlorophenyl)-N-(phenylmethyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride

Systemtic Name: 5-(4-chlorophenyl)-N-(phenylmethyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride Openeye Name: N-benzyl-5-(4-chlorophenyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride CAS Name: 5-(4-chlorophenyl)-N-(phenylmethyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride IUPAC Name: N-benzyl-5-(4-chlorophenyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine hydrochloride Traditional Name: benzyl-[5-(4-chlorophenyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-yl]amine hydrochloride Formula: C22H21Cl2N3 MolecularWeight: 398.32824

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2NC(=N1)NCC3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl

Isomeric SMILES

C1C(C2=CC=CC=C2NC(=N1)NCC3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl

InChI

InChI=1S/C22H20ClN3.ClH/c23-18-12-10-17(11-13-18)20-15-25-22(24-14-16-6-2-1-3-7-16)26-21-9-5-4-8-19(20)21;/h1-13,20H,14-15H2,(H2,24,25,26);1H