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

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 2,3,4-trimethoxybenzoate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3)OC)OC

InChI

InChI=1S/C21H20N2O6/c1-26-17-10-9-14(19(27-2)20(17)28-3)21(25)29-12-18(24)23-16-8-4-7-15-13(16)6-5-11-22-15/h4-11H,12H2,1-3H3,(H,23,24)