2-methyl-4-[2-oxidanyl-3-(3-phenylpropylamino)propoxy]phthalazin-1-one

Systemtic Name: 2-methyl-4-[2-oxidanyl-3-(3-phenylpropylamino)propoxy]phthalazin-1-one Openeye Name: 4-[2-hydroxy-3-(3-phenylpropylamino)propoxy]-2-methyl-phthalazin-1-one CAS Name: 4-[2-hydroxy-3-(3-phenylpropylamino)propoxy]-2-methyl-1-phthalazinone IUPAC Name: 4-[2-hydroxy-3-(3-phenylpropylamino)propoxy]-2-methylphthalazin-1-one Traditional Name: 4-[2-hydroxy-3-(3-phenylpropylamino)propoxy]-2-methyl-phthalazin-1-one Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)OCC(CNCCCC3=CC=CC=C3)O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)OCC(CNCCCC3=CC=CC=C3)O

InChI

InChI=1S/C21H25N3O3/c1-24-21(26)19-12-6-5-11-18(19)20(23-24)27-15-17(25)14-22-13-7-10-16-8-3-2-4-9-16/h2-6,8-9,11-12,17,22,25H,7,10,13-15H2,1H3