1-(phenylmethyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyrazole-4-carboxamide CAS Name: 1-(phenylmethyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-pyrazole-4-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN(N=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C22H21N3O3/c26-21(17-13-23-25(15-17)14-16-6-2-1-3-7-16)24-18-8-9-19-20(12-18)28-22(27-19)10-4-5-11-22/h1-3,6-9,12-13,15H,4-5,10-11,14H2,(H,24,26)