(2R,3R)-2-(4-chlorophenyl)-3-(4-nitrophenyl)-3-oxidanyl-2H-chromen-4-one

Systemtic Name: (2R,3R)-2-(4-chlorophenyl)-3-(4-nitrophenyl)-3-oxidanyl-2H-chromen-4-one Openeye Name: (2R,3R)-2-(4-chlorophenyl)-3-hydroxy-3-(4-nitrophenyl)chroman-4-one CAS Name: (2R,3R)-2-(4-chlorophenyl)-3-hydroxy-3-(4-nitrophenyl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (2R,3R)-2-(4-chlorophenyl)-3-hydroxy-3-(4-nitrophenyl)-2H-chromen-4-one Traditional Name: (2R,3R)-2-(4-chlorophenyl)-3-hydroxy-3-(4-nitrophenyl)chroman-4-one Formula: C21H14ClNO5 MolecularWeight: 395.79256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C(O2)C3=CC=C(C=C3)Cl)(C4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)[C@]([C@H](O2)C3=CC=C(C=C3)Cl)(C4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C21H14ClNO5/c22-15-9-5-13(6-10-15)20-21(25,14-7-11-16(12-8-14)23(26)27)19(24)17-3-1-2-4-18(17)28-20/h1-12,20,25H/t20-,21+/m1/s1