2-[(2S)-3-[(4-chlorophenyl)methoxy]-2-oxidanyl-propyl]-4-phenyl-phthalazin-1-one

Systemtic Name: 2-[(2S)-3-[(4-chlorophenyl)methoxy]-2-oxidanyl-propyl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[(2S)-3-[(4-chlorophenyl)methoxy]-2-hydroxy-propyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[(2S)-3-[(4-chlorophenyl)methoxy]-2-hydroxypropyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[(2S)-3-[(4-chlorophenyl)methoxy]-2-hydroxypropyl]-4-phenylphthalazin-1-one Traditional Name: 2-[(2S)-3-(4-chlorobenzyl)oxy-2-hydroxy-propyl]-4-phenyl-phthalazin-1-one Formula: C24H21ClN2O3 MolecularWeight: 420.88814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(COCC4=CC=C(C=C4)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C[C@@H](COCC4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C24H21ClN2O3/c25-19-12-10-17(11-13-19)15-30-16-20(28)14-27-24(29)22-9-5-4-8-21(22)23(26-27)18-6-2-1-3-7-18/h1-13,20,28H,14-16H2/t20-/m0/s1