N-[(3,4-dimethoxyphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]cyclohexanecarboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]cyclohexanecarboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)-(8-hydroxy-5-nitro-7-quinolyl)methyl]cyclohexanecarboxamide CAS Name: N-[(3,4-dimethoxyphenyl)-(8-hydroxy-5-nitro-7-quinolinyl)methyl]cyclohexanecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)-(8-hydroxy-5-nitroquinolin-7-yl)methyl]cyclohexanecarboxamide Traditional Name: N-[(3,4-dimethoxyphenyl)-(8-hydroxy-5-nitro-7-quinolyl)methyl]cyclohexanecarboxamide Formula: C25H27N3O6 MolecularWeight: 465.49838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])NC(=O)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])NC(=O)C4CCCCC4)OC

InChI

InChI=1S/C25H27N3O6/c1-33-20-11-10-16(13-21(20)34-2)22(27-25(30)15-7-4-3-5-8-15)18-14-19(28(31)32)17-9-6-12-26-23(17)24(18)29/h6,9-15,22,29H,3-5,7-8H2,1-2H3,(H,27,30)