4-[[4-ethoxycarbonyl-1-(2-methoxyethyl)-5-methyl-2-oxidanylidene-pyrrol-3-ylidene]methyl]benzoic acid

Systemtic Name: 4-[[4-ethoxycarbonyl-1-(2-methoxyethyl)-5-methyl-2-oxidanylidene-pyrrol-3-ylidene]methyl]benzoic acid Openeye Name: 4-[[4-ethoxycarbonyl-1-(2-methoxyethyl)-5-methyl-2-oxo-pyrrol-3-ylidene]methyl]benzoic acid CAS Name: 4-[[4-ethoxycarbonyl-1-(2-methoxyethyl)-5-methyl-2-oxo-3-pyrrolylidene]methyl]benzoic acid IUPAC Name: 4-[[4-ethoxycarbonyl-1-(2-methoxyethyl)-5-methyl-2-oxopyrrol-3-ylidene]methyl]benzoic acid Traditional Name: 4-[[4-carbethoxy-2-keto-1-(2-methoxyethyl)-5-methyl-2-pyrrolin-3-ylidene]methyl]benzoic acid Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)C(=O)O)CCOC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)C(=O)O)CCOC)C

InChI

InChI=1S/C19H21NO6/c1-4-26-19(24)16-12(2)20(9-10-25-3)17(21)15(16)11-13-5-7-14(8-6-13)18(22)23/h5-8,11H,4,9-10H2,1-3H3,(H,22,23)