N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-homoveratryl-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

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