6-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-oxidanylidene-1H-quinoline-2-carboxamide

Systemtic Name: 6-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-oxidanylidene-1H-quinoline-2-carboxamide Openeye Name: 6-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-oxo-1H-quinoline-2-carboxamide CAS Name: 6-methyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-4-oxo-1H-quinoline-2-carboxamide IUPAC Name: 6-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-oxo-1H-quinoline-2-carboxamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-4-keto-6-methyl-1H-quinoline-2-carboxamide Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=CC2=O)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CC2=O)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C

InChI

InChI=1S/C22H23N3O3/c1-13(2)21(27)24-16-6-4-5-15(10-16)12-23-22(28)19-11-20(26)17-9-14(3)7-8-18(17)25-19/h4-11,13H,12H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)