[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-methoxy-benzoate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-methoxy-benzoate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-ethoxy-4-methoxy-benzoate CAS Name: 3-ethoxy-4-methoxybenzoic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 3-ethoxy-4-methoxybenzoate Traditional Name: 3-ethoxy-4-methoxy-benzoic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)OC)OC

InChI

InChI=1S/C21H25NO6/c1-5-27-19-12-16(8-11-18(19)26-4)21(24)28-14(2)20(23)22-13-15-6-9-17(25-3)10-7-15/h6-12,14H,5,13H2,1-4H3,(H,22,23)