2-[3-[4-(1H-pyrrol-2-yl)phenyl]propanoylamino]benzoic acid

Systemtic Name: 2-[3-[4-(1H-pyrrol-2-yl)phenyl]propanoylamino]benzoic acid Openeye Name: 2-[3-[4-(1H-pyrrol-2-yl)phenyl]propanoylamino]benzoic acid CAS Name: 2-[[1-oxo-3-[4-(1H-pyrrol-2-yl)phenyl]propyl]amino]benzoic acid IUPAC Name: 2-[3-[4-(1H-pyrrol-2-yl)phenyl]propanoylamino]benzoic acid Traditional Name: 2-[3-[4-(1H-pyrrol-2-yl)phenyl]propanoylamino]benzoic acid Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=C(C=C2)C3=CC=CN3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=C(C=C2)C3=CC=CN3

InChI

InChI=1S/C20H18N2O3/c23-19(22-18-5-2-1-4-16(18)20(24)25)12-9-14-7-10-15(11-8-14)17-6-3-13-21-17/h1-8,10-11,13,21H,9,12H2,(H,22,23)(H,24,25)