N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]pyrazole-4-carboxamide CAS Name: N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]pyrazole-4-carboxamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CNC(=O)C2=CN(N=C2)CC3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCC(C1)(CNC(=O)C2=CN(N=C2)CC3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H27N3O3/c29-24(20-15-27-28(17-20)16-19-6-2-1-3-7-19)26-18-25(10-4-5-11-25)21-8-9-22-23(14-21)31-13-12-30-22/h1-3,6-9,14-15,17H,4-5,10-13,16,18H2,(H,26,29)