5-nitro-2-[(1-oxidanylcyclohexyl)amino]-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 5-nitro-2-[(1-oxidanylcyclohexyl)amino]-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 2-[(1-hydroxycyclohexyl)amino]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 2-[(1-hydroxycyclohexyl)amino]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 2-[(1-hydroxycyclohexyl)amino]-5-nitro-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 2-[(1-hydroxycyclohexyl)amino]-5-nitro-N-(3,4,5-trimethoxybenzyl)benzamide Formula: C23H29N3O7 MolecularWeight: 459.49226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3(CCCCC3)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3(CCCCC3)O

InChI

InChI=1S/C23H29N3O7/c1-31-19-11-15(12-20(32-2)21(19)33-3)14-24-22(27)17-13-16(26(29)30)7-8-18(17)25-23(28)9-5-4-6-10-23/h7-8,11-13,25,28H,4-6,9-10,14H2,1-3H3,(H,24,27)