5-(3,4-dimethylphenyl)-N-[3-(2-methylpiperidin-1-yl)propyl]-2-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[3-(2-methylpiperidin-1-yl)propyl]-2-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-[3-(2-methyl-1-piperidyl)propyl]-2-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-N-[3-(2-methyl-1-piperidinyl)propyl]-2-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-[3-(2-methylpiperidin-1-yl)propyl]-2-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-[3-(2-methylpiperidino)propyl]-2-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C27H33N5O3 MolecularWeight: 475.58262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C27H33N5O3/c1-19-8-9-22(17-20(19)2)25-18-26(31(29-25)23-10-12-24(13-11-23)32(34)35)27(33)28-14-6-16-30-15-5-4-7-21(30)3/h8-13,17-18,21H,4-7,14-16H2,1-3H3,(H,28,33)