N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-4-nitro-benzamide

Systemtic Name: N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-4-nitro-benzamide Openeye Name: N-[[4-[(4-methyl-1-piperidyl)methyl]phenyl]methyl]-4-nitro-benzamide CAS Name: N-[[4-[(4-methyl-1-piperidinyl)methyl]phenyl]methyl]-4-nitrobenzamide IUPAC Name: N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-4-nitrobenzamide Traditional Name: N-[4-[(4-methylpiperidino)methyl]benzyl]-4-nitro-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-16-10-12-23(13-11-16)15-18-4-2-17(3-5-18)14-22-21(25)19-6-8-20(9-7-19)24(26)27/h2-9,16H,10-15H2,1H3,(H,22,25)