N'-(4-azanylcyclohexyl)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzohydrazide

Systemtic Name: N'-(4-azanylcyclohexyl)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzohydrazide Openeye Name: N'-(4-aminocyclohexyl)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzohydrazide CAS Name: N'-(4-aminocyclohexyl)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitrobenzohydrazide IUPAC Name: N'-(4-aminocyclohexyl)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitrobenzohydrazide Traditional Name: N'-(4-aminocyclohexyl)-3-nitro-N-veratryl-benzohydrazide Formula: C22H28N4O5 MolecularWeight: 428.48152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC3CCC(CC3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC3CCC(CC3)N)OC

InChI

InChI=1S/C22H28N4O5/c1-30-20-11-6-15(12-21(20)31-2)14-25(24-18-9-7-17(23)8-10-18)22(27)16-4-3-5-19(13-16)26(28)29/h3-6,11-13,17-18,24H,7-10,14,23H2,1-2H3