4-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-3-methyl-benzoic acid CAS Name: 4-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[(4-bromo-1-methylpyrrole-2-carbonyl)amino]-3-methylbenzoic acid Traditional Name: 4-[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]-3-methyl-benzoic acid Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O3/c1-8-5-9(14(19)20)3-4-11(8)16-13(18)12-6-10(15)7-17(12)2/h3-7H,1-2H3,(H,16,18)(H,19,20)