4-(2-oxidanyl-3-phenylazanyl-propoxy)-2H-phthalazin-1-one

Systemtic Name: 4-(2-oxidanyl-3-phenylazanyl-propoxy)-2H-phthalazin-1-one Openeye Name: 4-(3-anilino-2-hydroxy-propoxy)-2H-phthalazin-1-one CAS Name: 4-(3-anilino-2-hydroxypropoxy)-2H-phthalazin-1-one IUPAC Name: 4-(3-anilino-2-hydroxypropoxy)-2H-phthalazin-1-one Traditional Name: 4-(3-anilino-2-hydroxy-propoxy)-2H-phthalazin-1-one Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC(COC2=NNC(=O)C3=CC=CC=C32)O

Isomeric SMILES

C1=CC=C(C=C1)NCC(COC2=NNC(=O)C3=CC=CC=C32)O

InChI

InChI=1S/C17H17N3O3/c21-13(10-18-12-6-2-1-3-7-12)11-23-17-15-9-5-4-8-14(15)16(22)19-20-17/h1-9,13,18,21H,10-11H2,(H,19,22)