[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-[2-(4-methoxyanilino)-2-oxo-ethoxy]benzoate CAS Name: 3-methoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-methoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(p-anisidino)ethoxy]-3-methoxy-benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OCC(=O)NCC#C)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OCC(=O)NCC#C)OC

InChI

InChI=1S/C22H22N2O7/c1-4-11-23-20(25)13-31-22(27)15-5-10-18(19(12-15)29-3)30-14-21(26)24-16-6-8-17(28-2)9-7-16/h1,5-10,12H,11,13-14H2,2-3H3,(H,23,25)(H,24,26)