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

Systemtic Name: 4-chloranyl-N-[1-(3-methylbutyl)-2-oxidanylidene-3,4-dihydroquinolin-6-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-(1-isopentyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-nitro-benzamide CAS Name: 4-chloro-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-(1-isoamyl-2-keto-3,4-dihydroquinolin-6-yl)-3-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=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O4/c1-13(2)9-10-24-18-7-5-16(11-14(18)4-8-20(24)26)23-21(27)15-3-6-17(22)19(12-15)25(28)29/h3,5-7,11-13H,4,8-10H2,1-2H3,(H,23,27)