N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-(3-chlorophenyl)-2-hydroxyethyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2-(3-chlorophenyl)-2-hydroxy-ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C17H14ClN3O3 MolecularWeight: 343.76436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NCC(C3=CC(=CC=C3)Cl)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NCC(C3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C17H14ClN3O3/c18-11-5-3-4-10(8-11)14(22)9-19-17(24)15-12-6-1-2-7-13(12)16(23)21-20-15/h1-8,14,22H,9H2,(H,19,24)(H,21,23)