N-[3-(hydroxymethyl)phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-[3-(hydroxymethyl)phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[3-(hydroxymethyl)phenyl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[3-(hydroxymethyl)phenyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[3-(hydroxymethyl)phenyl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-(3-methylolphenyl)-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)CO

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC(=C3)CO

InChI

InChI=1S/C20H23N3O4/c1-14-7-9-22(10-8-14)19-6-5-17(23(26)27)12-18(19)20(25)21-16-4-2-3-15(11-16)13-24/h2-6,11-12,14,24H,7-10,13H2,1H3,(H,21,25)