3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propanamide

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propanamide Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propanamide CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)propanamide IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylpropanamide Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-propionamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

InChI

InChI=1S/C25H27N3O3/c1-17-21(18(2)28(27-17)20-8-4-3-5-9-20)11-13-24(29)26-19-10-12-22-23(16-19)31-25(30-22)14-6-7-15-25/h3-5,8-10,12,16H,6-7,11,13-15H2,1-2H3,(H,26,29)