3-methyl-4-[(1-propan-2-ylpyrrol-2-yl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(1-propan-2-ylpyrrol-2-yl)carbonylamino]benzoic acid Openeye Name: 4-[(1-isopropylpyrrole-2-carbonyl)amino]-3-methyl-benzoic acid CAS Name: 3-methyl-4-[[oxo-(1-propan-2-yl-2-pyrrolyl)methyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(1-propan-2-ylpyrrole-2-carbonyl)amino]benzoic acid Traditional Name: 4-[(1-isopropylpyrrole-2-carbonyl)amino]-3-methyl-benzoic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC=CN2C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC=CN2C(C)C

InChI

InChI=1S/C16H18N2O3/c1-10(2)18-8-4-5-14(18)15(19)17-13-7-6-12(16(20)21)9-11(13)3/h4-10H,1-3H3,(H,17,19)(H,20,21)