[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO6/c1-25-17-12-16(13-18(26-2)20(17)27-3)21(24)28-14-19(23)22-11-7-10-15-8-5-4-6-9-15/h4-6,8-9,12-13H,7,10-11,14H2,1-3H3,(H,22,23)