4-[[(1-methylpyrrol-2-yl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(1-methylpyrrol-2-yl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(1-methylpyrrole-2-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(1-methylpyrrole-2-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(1-methylpyrrole-2-carbonyl)amino]methyl]benzoic acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C=CC=C1C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H14N2O3/c1-16-8-2-3-12(16)13(17)15-9-10-4-6-11(7-5-10)14(18)19/h2-8H,9H2,1H3,(H,15,17)(H,18,19)