N-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzamide

Systemtic Name: N-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzamide Openeye Name: N-[(3-benzyloxy-4-methoxy-phenyl)methyl]-2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzamide CAS Name: 2-[(4-hydroxycyclohexyl)amino]-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitrobenzamide IUPAC Name: 2-[(4-hydroxycyclohexyl)amino]-N-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-5-nitrobenzamide Traditional Name: N-(3-benzoxy-4-methoxy-benzyl)-2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzamide Formula: C28H31N3O6 MolecularWeight: 505.56224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCC(CC3)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCC(CC3)O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O6/c1-36-26-14-7-20(15-27(26)37-18-19-5-3-2-4-6-19)17-29-28(33)24-16-22(31(34)35)10-13-25(24)30-21-8-11-23(32)12-9-21/h2-7,10,13-16,21,23,30,32H,8-9,11-12,17-18H2,1H3,(H,29,33)