2-[5-(3-methoxyphenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid

Systemtic Name: 2-[5-(3-methoxyphenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid Openeye Name: 2-[5-(3-methoxybenzoyl)-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid CAS Name: 2-[5-[(3-methoxyphenyl)-oxomethyl]-2,3-dihydropyrrol-1-yl]-1-pyrrolecarboxylic acid IUPAC Name: 2-[5-(3-methoxybenzoyl)-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid Traditional Name: 2-(2-m-anisoyl-2-pyrrolin-1-yl)pyrrole-1-carboxylic acid Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2=CCCN2C3=CC=CN3C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C2=CCCN2C3=CC=CN3C(=O)O

InChI

InChI=1S/C17H16N2O4/c1-23-13-6-2-5-12(11-13)16(20)14-7-3-9-18(14)15-8-4-10-19(15)17(21)22/h2,4-8,10-11H,3,9H2,1H3,(H,21,22)