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

Systemtic Name: 4-[[(1-cyclopropylpyrrol-2-yl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(1-cyclopropylpyrrole-2-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(1-cyclopropyl-2-pyrrolyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(1-cyclopropylpyrrole-2-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(1-cyclopropylpyrrole-2-carbonyl)amino]methyl]benzoic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=CC=C2C(=O)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CC1N2C=CC=C2C(=O)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H16N2O3/c19-15(14-2-1-9-18(14)13-7-8-13)17-10-11-3-5-12(6-4-11)16(20)21/h1-6,9,13H,7-8,10H2,(H,17,19)(H,20,21)