5-chloranyl-N-[1-(3-methylbutyl)-2-oxidanylidene-3,4-dihydroquinolin-6-yl]-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-[1-(3-methylbutyl)-2-oxidanylidene-3,4-dihydroquinolin-6-yl]-2-nitro-benzamide Openeye Name: 5-chloro-N-(1-isopentyl-2-oxo-3,4-dihydroquinolin-6-yl)-2-nitro-benzamide CAS Name: 5-chloro-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]-2-nitrobenzamide Traditional Name: 5-chloro-N-(1-isoamyl-2-keto-3,4-dihydroquinolin-6-yl)-2-nitro-benzamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)CCC2=C1C=CC(=C2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN1C(=O)CCC2=C1C=CC(=C2)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O4/c1-13(2)9-10-24-18-7-5-16(11-14(18)3-8-20(24)26)23-21(27)17-12-15(22)4-6-19(17)25(28)29/h4-7,11-13H,3,8-10H2,1-2H3,(H,23,27)