N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-keto-N-methyl-3-phenyl-phthalazine-1-carboxamide Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O4/c1-27(15-18-16-31-21-13-7-8-14-22(21)32-18)25(30)23-19-11-5-6-12-20(19)24(29)28(26-23)17-9-3-2-4-10-17/h2-14,18H,15-16H2,1H3/t18-/m0/s1