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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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