N-[3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxidanyl-cyclohexyl]-3-nitro-benzamide

Systemtic Name: N-[3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxidanyl-cyclohexyl]-3-nitro-benzamide Openeye Name: N-[3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl]-3-nitro-benzamide CAS Name: N-[3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl]-3-nitrobenzamide IUPAC Name: N-[3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl]-3-nitrobenzamide Traditional Name: N-[3-(dimethylaminomethyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl]-3-nitro-benzamide Formula: C23H29N3O5 MolecularWeight: 427.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CC(CCC1(C2=CC(=CC=C2)OC)O)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1CC(CCC1(C2=CC(=CC=C2)OC)O)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O5/c1-25(2)15-18-13-19(24-22(27)16-6-4-8-20(12-16)26(29)30)10-11-23(18,28)17-7-5-9-21(14-17)31-3/h4-9,12,14,18-19,28H,10-11,13,15H2,1-3H3,(H,24,27)