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

Systemtic Name: 2-[2-(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)ethyl]aniline dihydrochloride Openeye Name: 2-[2-(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)ethyl]aniline dihydrochloride CAS Name: 2-[2-(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)ethyl]aniline dihydrochloride IUPAC Name: 2-[2-(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)ethyl]aniline dihydrochloride Traditional Name: [2-[2-(2-methyl-5-phenyl-1,5-dihydro-2,4-benzodiazepin-3-yl)ethyl]phenyl]amine dihydrochloride Formula: C24H27Cl2N3 MolecularWeight: 428.39728

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=CC=CC=C2C(N=C1CCC3=CC=CC=C3N)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

CN1CC2=CC=CC=C2C(N=C1CCC3=CC=CC=C3N)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C24H25N3.2ClH/c1-27-17-20-12-5-7-13-21(20)24(19-10-3-2-4-11-19)26-23(27)16-15-18-9-6-8-14-22(18)25;;/h2-14,24H,15-17,25H2,1H3;2*1H