[9-[3-(dimethylamino)pyrrolidin-1-yl]carbonyl-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-[4-(3-methoxyphenyl)-3-methyl-phenyl]methanone

Systemtic Name: [9-[3-(dimethylamino)pyrrolidin-1-yl]carbonyl-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-[4-(3-methoxyphenyl)-3-methyl-phenyl]methanone Openeye Name: [9-[3-(dimethylamino)pyrrolidine-1-carbonyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-[4-(3-methoxyphenyl)-3-methyl-phenyl]methanone CAS Name: [9-[[3-(dimethylamino)-1-pyrrolidinyl]-oxomethyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-[4-(3-methoxyphenyl)-3-methylphenyl]methanone IUPAC Name: [9-[3-(dimethylamino)pyrrolidine-1-carbonyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-[4-(3-methoxyphenyl)-3-methylphenyl]methanone Traditional Name: [9-[3-(dimethylamino)pyrrolidine-1-carbonyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-[4-(3-methoxyphenyl)-3-methyl-phenyl]methanone Formula: C34H36N4O3 MolecularWeight: 548.67464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CC3=CC=C(N3CC4=CC=CC=C42)C(=O)N5CCC(C5)N(C)C)C6=CC(=CC=C6)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CC3=CC=C(N3CC4=CC=CC=C42)C(=O)N5CCC(C5)N(C)C)C6=CC(=CC=C6)OC

InChI

InChI=1S/C34H36N4O3/c1-23-18-25(12-14-30(23)24-9-7-10-29(19-24)41-4)33(39)38-22-28-13-15-32(34(40)36-17-16-27(21-36)35(2)3)37(28)20-26-8-5-6-11-31(26)38/h5-15,18-19,27H,16-17,20-22H2,1-4H3