[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(3,4-diethoxyanilino)-2-oxo-ethyl] 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: 2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3,4-diethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-diethoxyanilino)-2-oxoethyl] 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: 2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3,4-diethoxyanilino)-2-keto-ethyl] ester Formula: C22H25NO7 MolecularWeight: 415.4364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)COC(=O)C2C(OC3=CC=CC=C3O2)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)COC(=O)C2C(OC3=CC=CC=C3O2)C)OCC

InChI

InChI=1S/C22H25NO7/c1-4-26-16-11-10-15(12-19(16)27-5-2)23-20(24)13-28-22(25)21-14(3)29-17-8-6-7-9-18(17)30-21/h6-12,14,21H,4-5,13H2,1-3H3,(H,23,24)