N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-nitro-benzamide

Systemtic Name: N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-nitro-benzamide Openeye Name: N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-nitro-benzamide CAS Name: N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-nitrobenzamide IUPAC Name: N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-nitrobenzamide Traditional Name: N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-nitro-benzamide Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCCCC2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCCCC2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H26N2O5/c1-28-19-11-8-17(14-20(19)29-2)22(12-4-3-5-13-22)15-23-21(25)16-6-9-18(10-7-16)24(26)27/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,23,25)