3-[3-(methylamino)-2-oxidanyl-propyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[3-(methylamino)-2-oxidanyl-propyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-hydroxy-3-(methylamino)propyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-hydroxy-3-(methylamino)propyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-hydroxy-3-(methylamino)propyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-hydroxy-3-(methylamino)propyl]-2H-phthalazine-1,4-quinone Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(CN1C(=O)C2=CC=CC=C2C(=O)N1)O

Isomeric SMILES

CNCC(CN1C(=O)C2=CC=CC=C2C(=O)N1)O

InChI

InChI=1S/C12H15N3O3/c1-13-6-8(16)7-15-12(18)10-5-3-2-4-9(10)11(17)14-15/h2-5,8,13,16H,6-7H2,1H3,(H,14,17)