4-[[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[4,5-bis(chloranyl)-1-methyl-pyrrol-2-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(4,5-dichloro-1-methyl-2-pyrrolyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4,5-dichloro-1-methylpyrrole-2-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(4,5-dichloro-1-methyl-pyrrole-2-carbonyl)amino]methyl]benzoic acid Formula: C14H12Cl2N2O3 MolecularWeight: 327.16268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Cl)Cl)C(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C(=CC(=C1Cl)Cl)C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H12Cl2N2O3/c1-18-11(6-10(15)12(18)16)13(19)17-7-8-2-4-9(5-3-8)14(20)21/h2-6H,7H2,1H3,(H,17,19)(H,20,21)