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

Systemtic Name: [3-methoxy-4-(3-methoxyphenyl)phenyl]-[9-(4-pyrrolidin-1-ylpiperidin-1-yl)carbonyl-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone Openeye Name: [3-methoxy-4-(3-methoxyphenyl)phenyl]-[9-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone CAS Name: [3-methoxy-4-(3-methoxyphenyl)phenyl]-[9-[oxo-[4-(1-pyrrolidinyl)-1-piperidinyl]methyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone IUPAC Name: [3-methoxy-4-(3-methoxyphenyl)phenyl]-[9-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone Traditional Name: [3-methoxy-4-(3-methoxyphenyl)phenyl]-[9-(4-pyrrolidinopiperidine-1-carbonyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]methanone Formula: C37H40N4O4 MolecularWeight: 604.7379

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C=C(C=C2)C(=O)N3CC4=CC=C(N4CC5=CC=CC=C53)C(=O)N6CCC(CC6)N7CCCC7)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C=C(C=C2)C(=O)N3CC4=CC=C(N4CC5=CC=CC=C53)C(=O)N6CCC(CC6)N7CCCC7)OC

InChI

InChI=1S/C37H40N4O4/c1-44-31-10-7-9-26(22-31)32-14-12-27(23-35(32)45-2)36(42)41-25-30-13-15-34(40(30)24-28-8-3-4-11-33(28)41)37(43)39-20-16-29(17-21-39)38-18-5-6-19-38/h3-4,7-15,22-23,29H,5-6,16-21,24-25H2,1-2H3