N-(2-bromanyl-4-methyl-phenyl)-1-butyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-1-butyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-1-butyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-1-butyl-2-hydroxy-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-1-butyl-2-hydroxy-4-oxoquinoline-3-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-1-butyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=C(C=C(C=C3)C)Br

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=C(C=C(C=C3)C)Br

InChI

InChI=1S/C21H21BrN2O3/c1-3-4-11-24-17-8-6-5-7-14(17)19(25)18(21(24)27)20(26)23-16-10-9-13(2)12-15(16)22/h5-10,12,27H,3-4,11H2,1-2H3,(H,23,26)