4-[2-[1-(4-methoxyphenyl)-2,5-dihydro-1H-2,4-benzodiazepin-3-yl]ethyl]aniline

Systemtic Name: 4-[2-[1-(4-methoxyphenyl)-2,5-dihydro-1H-2,4-benzodiazepin-3-yl]ethyl]aniline Openeye Name: 4-[2-[1-(4-methoxyphenyl)-2,5-dihydro-1H-2,4-benzodiazepin-3-yl]ethyl]aniline CAS Name: 4-[2-[1-(4-methoxyphenyl)-2,5-dihydro-1H-2,4-benzodiazepin-3-yl]ethyl]aniline IUPAC Name: 4-[2-[1-(4-methoxyphenyl)-2,5-dihydro-1H-2,4-benzodiazepin-3-yl]ethyl]aniline Traditional Name: [4-[2-[1-(4-methoxyphenyl)-2,5-dihydro-1H-2,4-benzodiazepin-3-yl]ethyl]phenyl]amine Formula: C24H25N3O MolecularWeight: 371.4748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3=CC=CC=C3CN=C(N2)CCC4=CC=C(C=C4)N

Isomeric SMILES

COC1=CC=C(C=C1)C2C3=CC=CC=C3CN=C(N2)CCC4=CC=C(C=C4)N

InChI

InChI=1S/C24H25N3O/c1-28-21-13-9-18(10-14-21)24-22-5-3-2-4-19(22)16-26-23(27-24)15-8-17-6-11-20(25)12-7-17/h2-7,9-14,24H,8,15-16,25H2,1H3,(H,26,27)