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

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-[1-(phenylmethyl)piperidin-4-yl]pyrazole-3-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-[1-(phenylmethyl)-4-piperidinyl]-3-pyrazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C30H31N5O3 MolecularWeight: 509.59884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C

InChI

InChI=1S/C30H31N5O3/c1-21-11-12-24(17-22(21)2)28-19-29(34(32-28)26-9-6-10-27(18-26)35(37)38)30(36)31-25-13-15-33(16-14-25)20-23-7-4-3-5-8-23/h3-12,17-19,25H,13-16,20H2,1-2H3,(H,31,36)