N-[(S)-(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(2-chlorophenyl)methyl]pentanamide

Systemtic Name: N-[(S)-(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(2-chlorophenyl)methyl]pentanamide Openeye Name: N-[(S)-(5-chloro-8-hydroxy-7-quinolyl)-(2-chlorophenyl)methyl]pentanamide CAS Name: N-[(S)-(5-chloro-8-hydroxy-7-quinolinyl)-(2-chlorophenyl)methyl]pentanamide IUPAC Name: N-[(S)-(5-chloro-8-hydroxyquinolin-7-yl)-(2-chlorophenyl)methyl]pentanamide Traditional Name: N-[(S)-(5-chloro-8-hydroxy-7-quinolyl)-(2-chlorophenyl)methyl]valeramide Formula: C21H20Cl2N2O2 MolecularWeight: 403.3017

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(C1=CC=CC=C1Cl)C2=CC(=C3C=CC=NC3=C2O)Cl

Isomeric SMILES

CCCCC(=O)N[C@H](C1=CC=CC=C1Cl)C2=CC(=C3C=CC=NC3=C2O)Cl

InChI

InChI=1S/C21H20Cl2N2O2/c1-2-3-10-18(26)25-19(13-7-4-5-9-16(13)22)15-12-17(23)14-8-6-11-24-20(14)21(15)27/h4-9,11-12,19,27H,2-3,10H2,1H3,(H,25,26)/t19-/m1/s1