N-[2-(5,8-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(5,8-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-(5,8-dimethoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-(5,8-dimethoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-(5,8-dimethoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-(2-keto-5,8-dimethoxy-1H-quinolin-3-yl)ethyl]-4-methyl-3-nitro-benzamide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC2=CC3=C(C=CC(=C3NC2=O)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC2=CC3=C(C=CC(=C3NC2=O)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O6/c1-12-4-5-13(11-16(12)24(27)28)20(25)22-9-8-14-10-15-17(29-2)6-7-18(30-3)19(15)23-21(14)26/h4-7,10-11H,8-9H2,1-3H3,(H,22,25)(H,23,26)