N-[(E)-(3-chlorophenyl)methylideneamino]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-[(E)-(3-chlorophenyl)methylideneamino]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: N-[(E)-(3-chlorophenyl)methyleneamino]-2-hydroxy-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: N-[(E)-(3-chlorophenyl)methylideneamino]-2-hydroxy-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: N-[(E)-(3-chlorophenyl)methylideneamino]-2-hydroxy-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: 1-amyl-N-[(E)-(3-chlorobenzylidene)amino]-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NN=CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)N/N=C/C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H22ClN3O3/c1-2-3-6-12-26-18-11-5-4-10-17(18)20(27)19(22(26)29)21(28)25-24-14-15-8-7-9-16(23)13-15/h4-5,7-11,13-14,29H,2-3,6,12H2,1H3,(H,25,28)/b24-14+