4-[3-[(2-aminophenyl)amino]-2-oxidanyl-propoxy]-2H-phthalazin-1-one

Systemtic Name: 4-[3-[(2-aminophenyl)amino]-2-oxidanyl-propoxy]-2H-phthalazin-1-one Openeye Name: 4-[3-(2-aminoanilino)-2-hydroxy-propoxy]-2H-phthalazin-1-one CAS Name: 4-[3-(2-aminoanilino)-2-hydroxypropoxy]-2H-phthalazin-1-one IUPAC Name: 4-[3-(2-aminoanilino)-2-hydroxypropoxy]-2H-phthalazin-1-one Traditional Name: 4-[3-(2-aminoanilino)-2-hydroxy-propoxy]-2H-phthalazin-1-one Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2OCC(CNC3=CC=CC=C3N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2OCC(CNC3=CC=CC=C3N)O

InChI

InChI=1S/C17H18N4O3/c18-14-7-3-4-8-15(14)19-9-11(22)10-24-17-13-6-2-1-5-12(13)16(23)20-21-17/h1-8,11,19,22H,9-10,18H2,(H,20,23)