8-chloranyl-4-oxidanylidene-5-(6-phenylhexyl)-1H-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-4-oxidanylidene-5-(6-phenylhexyl)-1H-quinoline-3-carboxylic acid Openeye Name: 8-chloro-4-oxo-5-(6-phenylhexyl)-1H-quinoline-3-carboxylic acid CAS Name: 8-chloro-4-oxo-5-(6-phenylhexyl)-1H-quinoline-3-carboxylic acid IUPAC Name: 8-chloro-4-oxo-5-(6-phenylhexyl)-1H-quinoline-3-carboxylic acid Traditional Name: 8-chloro-4-keto-5-(6-phenylhexyl)-1H-quinoline-3-carboxylic acid Formula: C22H22ClNO3 MolecularWeight: 383.86798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC2=C3C(=C(C=C2)Cl)NC=C(C3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC2=C3C(=C(C=C2)Cl)NC=C(C3=O)C(=O)O

InChI

InChI=1S/C22H22ClNO3/c23-18-13-12-16(19-20(18)24-14-17(21(19)25)22(26)27)11-7-2-1-4-8-15-9-5-3-6-10-15/h3,5-6,9-10,12-14H,1-2,4,7-8,11H2,(H,24,25)(H,26,27)