N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O4/c30-25(27-13-12-18-10-11-22-23(16-18)33-15-14-32-22)24-20-8-4-5-9-21(20)26(31)29(28-24)17-19-6-2-1-3-7-19/h1-11,16H,12-15,17H2,(H,27,30)