N-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]benzamide

Systemtic Name: N-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]benzamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-methyl-2-(4-methyl-1-piperidinyl)-5-nitro-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]benzamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C)CC3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C)CC3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3/c1-19-10-12-28(13-11-19)24-9-8-22(30(32)33)14-23(24)25(31)27(2)16-21-15-26-29(18-21)17-20-6-4-3-5-7-20/h3-9,14-15,18-19H,10-13,16-17H2,1-2H3