4-(3-cyanopyrrolo[1,2-a]quinolin-1-yl)carbonylbenzoic acid

Systemtic Name: 4-(3-cyanopyrrolo[1,2-a]quinolin-1-yl)carbonylbenzoic acid Openeye Name: 4-(3-cyanopyrrolo[1,2-a]quinoline-1-carbonyl)benzoic acid CAS Name: 4-[(3-cyano-1-pyrrolo[1,2-a]quinolinyl)-oxomethyl]benzoic acid IUPAC Name: 4-(3-cyanopyrrolo[1,2-a]quinoline-1-carbonyl)benzoic acid Traditional Name: 4-(3-cyanopyrrolo[1,2-a]quinoline-1-carbonyl)benzoic acid Formula: C21H12N2O3 MolecularWeight: 340.33158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C(C=C(N32)C(=O)C4=CC=C(C=C4)C(=O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C(C=C(N32)C(=O)C4=CC=C(C=C4)C(=O)O)C#N

InChI

InChI=1S/C21H12N2O3/c22-12-16-11-19(20(24)14-5-7-15(8-6-14)21(25)26)23-17-4-2-1-3-13(17)9-10-18(16)23/h1-11H,(H,25,26)