N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(3-methoxyphenyl)carbonyl-pyrrolidin-3-yl]-4-methoxy-N-phenethyl-benzamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-1-(3-methoxyphenyl)carbonyl-pyrrolidin-3-yl]-4-methoxy-N-phenethyl-benzamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(3-methoxybenzoyl)pyrrolidin-3-yl]-4-methoxy-N-phenethyl-benzamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-1-[(3-methoxyphenyl)-oxomethyl]-3-pyrrolidinyl]-4-methoxy-N-phenethylbenzamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-1-(3-methoxybenzoyl)pyrrolidin-3-yl]-4-methoxy-N-phenethylbenzamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-1-m-anisoyl-pyrrolidin-3-yl]-4-methoxy-N-phenethyl-benzamide Formula: C34H40N4O5 MolecularWeight: 584.7052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)N5CCCNCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)N5CCCNCC5

InChI

InChI=1S/C34H40N4O5/c1-42-29-14-12-26(13-15-29)32(39)37(20-16-25-8-4-3-5-9-25)28-23-31(34(41)36-19-7-17-35-18-21-36)38(24-28)33(40)27-10-6-11-30(22-27)43-2/h3-6,8-15,22,28,31,35H,7,16-21,23-24H2,1-2H3