4-(1,3-benzodioxol-5-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one Openeye Name: 4-(1,3-benzodioxol-5-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one CAS Name: 4-(1,3-benzodioxol-5-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one IUPAC Name: 4-(1,3-benzodioxol-5-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one Traditional Name: 4-(1,3-benzodioxol-5-yl)-4a,5,6,7,8,8a-hexahydro-2H-phthalazin-1-one Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=NNC2=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC2C(C1)C(=NNC2=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H16N2O3/c18-15-11-4-2-1-3-10(11)14(16-17-15)9-5-6-12-13(7-9)20-8-19-12/h5-7,10-11H,1-4,8H2,(H,17,18)