N-(2-cyanophenyl)-1-(3-methylbutyl)-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(2-cyanophenyl)-1-(3-methylbutyl)-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(2-cyanophenyl)-2-hydroxy-1-isopentyl-4-oxo-quinoline-3-carboxamide CAS Name: N-(2-cyanophenyl)-2-hydroxy-1-(3-methylbutyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(2-cyanophenyl)-2-hydroxy-1-(3-methylbutyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(2-cyanophenyl)-2-hydroxy-1-isoamyl-4-keto-quinoline-3-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C22H21N3O3/c1-14(2)11-12-25-18-10-6-4-8-16(18)20(26)19(22(25)28)21(27)24-17-9-5-3-7-15(17)13-23/h3-10,14,28H,11-12H2,1-2H3,(H,24,27)