[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid [2-keto-2-[(3,4,5-trimethoxybenzyl)amino]ethyl] ester Formula: C20H28N2O7 MolecularWeight: 408.44552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)COC(=O)CN2CCCCCC2=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)COC(=O)CN2CCCCCC2=O

InChI

InChI=1S/C20H28N2O7/c1-26-15-9-14(10-16(27-2)20(15)28-3)11-21-17(23)13-29-19(25)12-22-8-6-4-5-7-18(22)24/h9-10H,4-8,11-13H2,1-3H3,(H,21,23)