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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)isonipecotamide Formula: C25H25ClN4O4 MolecularWeight: 480.9434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)Cl)CC5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C25H25ClN4O4/c1-16-22(23(26)30(28-16)14-17-5-3-2-4-6-17)25(32)29-11-9-18(10-12-29)24(31)27-19-7-8-20-21(13-19)34-15-33-20/h2-8,13,18H,9-12,14-15H2,1H3,(H,27,31)