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

Systemtic Name: N-[3-(2-methylpiperidin-1-yl)propyl]-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-[3-(2-methyl-1-piperidyl)propyl]-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-[3-(2-methyl-1-piperidinyl)propyl]-2-(4-nitrophenyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(2-methylpiperidin-1-yl)propyl]-2-(4-nitrophenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: N-[3-(2-methylpiperidino)propyl]-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N5O3/c1-19-8-5-6-16-28(19)17-7-15-26-25(31)24-18-23(20-9-3-2-4-10-20)27-29(24)21-11-13-22(14-12-21)30(32)33/h2-4,9-14,18-19H,5-8,15-17H2,1H3,(H,26,31)