5-[5-chloranyl-4-(cyclohexen-1-yl)-2-methoxy-phenyl]carbonyl-N-methyl-N-(2,3,4,5,6-pentamethoxyhexyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide

Systemtic Name: 5-[5-chloranyl-4-(cyclohexen-1-yl)-2-methoxy-phenyl]carbonyl-N-methyl-N-(2,3,4,5,6-pentamethoxyhexyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide Openeye Name: 5-[5-chloro-4-(cyclohexen-1-yl)-2-methoxy-benzoyl]-N-methyl-N-(2,3,4,5,6-pentamethoxyhexyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide CAS Name: 5-[[5-chloro-4-(1-cyclohexenyl)-2-methoxyphenyl]-oxomethyl]-N-methyl-N-(2,3,4,5,6-pentamethoxyhexyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide IUPAC Name: 5-[5-chloro-4-(cyclohexen-1-yl)-2-methoxybenzoyl]-N-methyl-N-(2,3,4,5,6-pentamethoxyhexyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide Traditional Name: 5-[5-chloro-4-(cyclohexen-1-yl)-2-methoxy-benzoyl]-N-methyl-N-(2,3,4,5,6-pentamethoxyhexyl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide Formula: C39H50ClN3O8 MolecularWeight: 724.2826

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C(C(C(COC)OC)OC)OC)OC)C(=O)C1=CC=C2N1CC3=CC=CC=C3N(C2)C(=O)C4=C(C=C(C(=C4)Cl)C5=CCCCC5)OC

Isomeric SMILES

CN(CC(C(C(C(COC)OC)OC)OC)OC)C(=O)C1=CC=C2N1CC3=CC=CC=C3N(C2)C(=O)C4=C(C=C(C(=C4)Cl)C5=CCCCC5)OC

InChI

InChI=1S/C39H50ClN3O8/c1-41(23-34(48-4)36(50-6)37(51-7)35(49-5)24-46-2)39(45)32-18-17-27-22-43(31-16-12-11-15-26(31)21-42(27)32)38(44)29-19-30(40)28(20-33(29)47-3)25-13-9-8-10-14-25/h11-13,15-20,34-37H,8-10,14,21-24H2,1-7H3