4-[(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)methyl]aniline dihydrochloride

Systemtic Name: 4-[(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)methyl]aniline dihydrochloride Openeye Name: 4-[(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)methyl]aniline dihydrochloride CAS Name: 4-[(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)methyl]aniline dihydrochloride IUPAC Name: 4-[(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)methyl]aniline dihydrochloride Traditional Name: [4-[(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)methyl]phenyl]amine dihydrochloride Formula: C23H25Cl2N3 MolecularWeight: 414.3707

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=CC=CC=C2C(N=C1CC3=CC=C(C=C3)N)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

CN1CC2=CC=CC=C2C(N=C1CC3=CC=C(C=C3)N)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C23H23N3.2ClH/c1-26-16-19-9-5-6-10-21(19)23(18-7-3-2-4-8-18)25-22(26)15-17-11-13-20(24)14-12-17;;/h2-14,23H,15-16,24H2,1H3;2*1H