4-[2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-2-oxoethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxoethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-2-keto-ethyl]-2H-phthalazin-1-one Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=NNC(=O)C3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CC2=NNC(=O)C3=CC=CC=C32)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C22H21N3O4/c26-21(13-17-15-4-1-2-5-16(15)22(27)24-23-17)25-9-3-6-18(25)14-7-8-19-20(12-14)29-11-10-28-19/h1-2,4-5,7-8,12,18H,3,6,9-11,13H2,(H,24,27)/t18-/m1/s1