N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O4/c1-28(16-19-11-12-22-23(15-19)33-14-13-32-22)26(31)24-20-9-5-6-10-21(20)25(30)29(27-24)17-18-7-3-2-4-8-18/h2-12,15H,13-14,16-17H2,1H3