3-[2-oxidanylidene-2-[2-(phenylmethyl)pyrrolidin-1-yl]ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-oxidanylidene-2-[2-(phenylmethyl)pyrrolidin-1-yl]ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-(2-benzylpyrrolidin-1-yl)-2-oxo-ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-oxo-2-[2-(phenylmethyl)-1-pyrrolidinyl]ethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-(2-benzylpyrrolidin-1-yl)-2-oxoethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-(2-benzylpyrrolidino)-2-keto-ethyl]-2H-phthalazine-1,4-quinone Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)CC4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3/c25-19(23-12-6-9-16(23)13-15-7-2-1-3-8-15)14-24-21(27)18-11-5-4-10-17(18)20(26)22-24/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,22,26)