4-oxidanylidene-3-pentyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

InChI

InChI=1S/C25H27N3O4/c1-2-3-8-15-28-24(30)19-10-5-4-9-18(19)22(27-28)23(29)26-17-11-12-20-21(16-17)32-25(31-20)13-6-7-14-25/h4-5,9-12,16H,2-3,6-8,13-15H2,1H3,(H,26,29)