methyl 3-[4-(1H-indol-6-ylcarbonyl)-6-[(3-methoxyphenyl)methoxy]-2-oxidanylidene-1,4-diazepan-1-yl]propanoate

Systemtic Name: methyl 3-[4-(1H-indol-6-ylcarbonyl)-6-[(3-methoxyphenyl)methoxy]-2-oxidanylidene-1,4-diazepan-1-yl]propanoate Openeye Name: methyl 3-[4-(1H-indole-6-carbonyl)-6-[(3-methoxyphenyl)methoxy]-2-oxo-1,4-diazepan-1-yl]propanoate CAS Name: 3-[4-[1H-indol-6-yl(oxo)methyl]-6-[(3-methoxyphenyl)methoxy]-2-oxo-1,4-diazepan-1-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(1H-indole-6-carbonyl)-6-[(3-methoxyphenyl)methoxy]-2-oxo-1,4-diazepan-1-yl]propanoate Traditional Name: 3-[4-(1H-indole-6-carbonyl)-2-keto-6-m-anisyloxy-1,4-diazepan-1-yl]propionic acid methyl ester Formula: C26H29N3O6 MolecularWeight: 479.52496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CCC(=O)OC)C(=O)C3=CC4=C(C=C3)C=CN4

Isomeric SMILES

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CCC(=O)OC)C(=O)C3=CC4=C(C=C3)C=CN4

InChI

InChI=1S/C26H29N3O6/c1-33-21-5-3-4-18(12-21)17-35-22-14-28(11-9-25(31)34-2)24(30)16-29(15-22)26(32)20-7-6-19-8-10-27-23(19)13-20/h3-8,10,12-13,22,27H,9,11,14-17H2,1-2H3