2-(carboxymethyl)-2-ethyl-4-methyl-5-(phenylcarbonyl)pyrrole-3-carboxylic acid

Systemtic Name: 2-(carboxymethyl)-2-ethyl-4-methyl-5-(phenylcarbonyl)pyrrole-3-carboxylic acid Openeye Name: 5-benzoyl-2-(carboxymethyl)-2-ethyl-4-methyl-pyrrole-3-carboxylic acid CAS Name: 5-benzoyl-2-(carboxymethyl)-2-ethyl-4-methyl-3-pyrrolecarboxylic acid IUPAC Name: 5-benzoyl-2-(carboxymethyl)-2-ethyl-4-methylpyrrole-3-carboxylic acid Traditional Name: 5-benzoyl-2-(carboxymethyl)-2-ethyl-4-methyl-pyrrole-3-carboxylic acid Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=N1)C(=O)C2=CC=CC=C2)C)C(=O)O)CC(=O)O

Isomeric SMILES

CCC1(C(=C(C(=N1)C(=O)C2=CC=CC=C2)C)C(=O)O)CC(=O)O

InChI

InChI=1S/C17H17NO5/c1-3-17(9-12(19)20)13(16(22)23)10(2)14(18-17)15(21)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,19,20)(H,22,23)