4-[[4,5-di(propan-2-yl)-1H-pyrrol-2-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[4,5-di(propan-2-yl)-1H-pyrrol-2-yl]carbonylamino]benzoic acid Openeye Name: 4-[(4,5-diisopropyl-1H-pyrrole-2-carbonyl)amino]benzoic acid CAS Name: 4-[[[4,5-di(propan-2-yl)-1H-pyrrol-2-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4,5-di(propan-2-yl)-1H-pyrrole-2-carbonyl]amino]benzoic acid Traditional Name: 4-[(4,5-diisopropyl-1H-pyrrole-2-carbonyl)amino]benzoic acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)C(C)C

Isomeric SMILES

CC(C)C1=C(NC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O)C(C)C

InChI

InChI=1S/C18H22N2O3/c1-10(2)14-9-15(20-16(14)11(3)4)17(21)19-13-7-5-12(6-8-13)18(22)23/h5-11,20H,1-4H3,(H,19,21)(H,22,23)