2-[4-(1-benzofuran-2-yl)-6-chloranyl-2-methyl-quinolin-3-yl]pentanoic acid

Systemtic Name: 2-[4-(1-benzofuran-2-yl)-6-chloranyl-2-methyl-quinolin-3-yl]pentanoic acid Openeye Name: 2-[4-(benzofuran-2-yl)-6-chloro-2-methyl-3-quinolyl]pentanoic acid CAS Name: 2-[4-(2-benzofuranyl)-6-chloro-2-methyl-3-quinolinyl]pentanoic acid IUPAC Name: 2-[4-(1-benzofuran-2-yl)-6-chloro-2-methylquinolin-3-yl]pentanoic acid Traditional Name: 2-[4-(benzofuran-2-yl)-6-chloro-2-methyl-3-quinolyl]valeric acid Formula: C23H20ClNO3 MolecularWeight: 393.8628

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(N=C2C=CC(=CC2=C1C3=CC4=CC=CC=C4O3)Cl)C)C(=O)O

Isomeric SMILES

CCCC(C1=C(N=C2C=CC(=CC2=C1C3=CC4=CC=CC=C4O3)Cl)C)C(=O)O

InChI

InChI=1S/C23H20ClNO3/c1-3-6-16(23(26)27)21-13(2)25-18-10-9-15(24)12-17(18)22(21)20-11-14-7-4-5-8-19(14)28-20/h4-5,7-12,16H,3,6H2,1-2H3,(H,26,27)