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

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

Isomeric SMILES

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

InChI

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