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

Systemtic Name: 4-oxidanylidene-3-propan-2-yl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide CAS Name: 4-oxo-3-propan-2-yl-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propan-2-yl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-phthalazine-1-carboxamide Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCC5

InChI

InChI=1S/C23H23N3O4/c1-14(2)26-22(28)17-8-4-3-7-16(17)20(25-26)21(27)24-15-9-10-18-19(13-15)30-23(29-18)11-5-6-12-23/h3-4,7-10,13-14H,5-6,11-12H2,1-2H3,(H,24,27)