N-[3-(3,4-dimethoxyphenyl)-1-methyl-4-oxidanylidene-quinolin-2-yl]-3-nitro-benzamide

Systemtic Name: N-[3-(3,4-dimethoxyphenyl)-1-methyl-4-oxidanylidene-quinolin-2-yl]-3-nitro-benzamide Openeye Name: N-[3-(3,4-dimethoxyphenyl)-1-methyl-4-oxo-2-quinolyl]-3-nitro-benzamide CAS Name: N-[3-(3,4-dimethoxyphenyl)-1-methyl-4-oxo-2-quinolinyl]-3-nitrobenzamide IUPAC Name: N-[3-(3,4-dimethoxyphenyl)-1-methyl-4-oxoquinolin-2-yl]-3-nitrobenzamide Traditional Name: N-[3-(3,4-dimethoxyphenyl)-4-keto-1-methyl-2-quinolyl]-3-nitro-benzamide Formula: C25H21N3O6 MolecularWeight: 459.45074

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H21N3O6/c1-27-19-10-5-4-9-18(19)23(29)22(15-11-12-20(33-2)21(14-15)34-3)24(27)26-25(30)16-7-6-8-17(13-16)28(31)32/h4-14H,1-3H3,(H,26,30)