N-(1,3-benzodioxol-5-yl)-1-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[3,5-dimethyl-1-(p-tolylmethyl)pyrazole-4-carbonyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carbonyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[3,5-dimethyl-1-(4-methylbenzyl)pyrazole-4-carbonyl]isonipecotamide Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C27H30N4O4/c1-17-4-6-20(7-5-17)15-31-19(3)25(18(2)29-31)27(33)30-12-10-21(11-13-30)26(32)28-22-8-9-23-24(14-22)35-16-34-23/h4-9,14,21H,10-13,15-16H2,1-3H3,(H,28,32)