N-butyl-N-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-nitro-benzamide

Systemtic Name: N-butyl-N-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-nitro-benzamide Openeye Name: N-butyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-nitro-benzamide CAS Name: N-butyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-nitrobenzamide IUPAC Name: N-butyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-nitrobenzamide Traditional Name: N-butyl-N-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-3-nitro-benzamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC2=C(C=C(C=C2)C)NC1=O)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC1=CC2=C(C=C(C=C2)C)NC1=O)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O4/c1-3-4-10-24(22(27)17-6-5-7-19(13-17)25(28)29)14-18-12-16-9-8-15(2)11-20(16)23-21(18)26/h5-9,11-13H,3-4,10,14H2,1-2H3,(H,23,26)