4-[5-(8-ethyl-4-methyl-quinolin-2-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(8-ethyl-4-methyl-quinolin-2-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(8-ethyl-4-methyl-2-quinolyl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(8-ethyl-4-methyl-2-quinolinyl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(8-ethyl-4-methylquinolin-2-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(8-ethyl-4-methyl-2-quinolyl)-1H-pyrrol-2-yl]benzoic acid Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(C=C2C)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCC1=CC=CC2=C1N=C(C=C2C)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H20N2O2/c1-3-15-5-4-6-18-14(2)13-21(25-22(15)18)20-12-11-19(24-20)16-7-9-17(10-8-16)23(26)27/h4-13,24H,3H2,1-2H3,(H,26,27)