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

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2,3,4-trimethoxybenzoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-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=C(C(=C(C=C1)C(=O)OCC(=O)NCCCC2=CC=CC=C2)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)OCC(=O)NCCCC2=CC=CC=C2)OC)OC

InChI

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