2-[(5-ethoxycarbonyl-4-methyl-1H-pyrrol-3-yl)carbonyl]benzoic acid

Systemtic Name: 2-[(5-ethoxycarbonyl-4-methyl-1H-pyrrol-3-yl)carbonyl]benzoic acid Openeye Name: 2-(5-ethoxycarbonyl-4-methyl-1H-pyrrole-3-carbonyl)benzoic acid CAS Name: 2-[(5-ethoxycarbonyl-4-methyl-1H-pyrrol-3-yl)-oxomethyl]benzoic acid IUPAC Name: 2-(5-ethoxycarbonyl-4-methyl-1H-pyrrole-3-carbonyl)benzoic acid Traditional Name: 2-(5-carbethoxy-4-methyl-1H-pyrrole-3-carbonyl)benzoic acid Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1)C(=O)C2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1)C(=O)C2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C16H15NO5/c1-3-22-16(21)13-9(2)12(8-17-13)14(18)10-6-4-5-7-11(10)15(19)20/h4-8,17H,3H2,1-2H3,(H,19,20)