4-(3-carboxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(3-carboxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(3-carboxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-(3-carboxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(3-carboxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(3-carboxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=CC(=CC=C2)C(=O)O)C)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1C2=CC(=CC=C2)C(=O)O)C)C(=O)O

InChI

InChI=1S/C14H13NO4/c1-7-11(8(2)15-12(7)14(18)19)9-4-3-5-10(6-9)13(16)17/h3-6,15H,1-2H3,(H,16,17)(H,18,19)