N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-keto-phthalazine-1-carboxamide Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(/C)\C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H24N4O4/c1-3-4-7-12-27-23(29)18-9-6-5-8-17(18)21(26-27)22(28)25-24-15(2)16-10-11-19-20(13-16)31-14-30-19/h5-6,8-11,13H,3-4,7,12,14H2,1-2H3,(H,25,28)/b24-15-