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

Systemtic Name: 4-oxidanylidene-3-propyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-phthalazine-1-carboxamide Openeye Name: 4-oxo-3-propyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-phthalazine-1-carboxamide CAS Name: 4-oxo-3-propyl-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylphthalazine-1-carboxamide Traditional Name: 4-keto-3-propyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-phthalazine-1-carboxamide Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCCC5

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCCC5

InChI

InChI=1S/C24H25N3O4/c1-2-14-27-23(29)18-9-5-4-8-17(18)21(26-27)22(28)25-16-10-11-19-20(15-16)31-24(30-19)12-6-3-7-13-24/h4-5,8-11,15H,2-3,6-7,12-14H2,1H3,(H,25,28)