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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(C3=CC=C(C=C3)Cl)O)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)C[C@@H](C3=CC=C(C=C3)Cl)O)C(=O)N

InChI

InChI=1S/C17H14ClN3O3/c18-11-7-5-10(6-8-11)14(22)9-21-17(24)13-4-2-1-3-12(13)15(20-21)16(19)23/h1-8,14,22H,9H2,(H2,19,23)/t14-/m0/s1