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

Systemtic Name: N-[2-(dimethylaminomethyl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(dimethylaminomethyl)phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(dimethylaminomethyl)phenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(dimethylaminomethyl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(dimethylaminomethyl)phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3CN(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3CN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O3/c1-16-10-12-25(13-11-16)20-9-8-17(14-21(20)26(28)29)22(27)23-19-7-5-4-6-18(19)15-24(2)3/h4-9,14,16H,10-13,15H2,1-3H3,(H,23,27)