(2E)-2-[(3,5-dimethyl-4-oxidanyl-phenyl)methylidene]-6-methoxy-4-nitro-5-oxidanyl-3H-inden-1-one

Systemtic Name: (2E)-2-[(3,5-dimethyl-4-oxidanyl-phenyl)methylidene]-6-methoxy-4-nitro-5-oxidanyl-3H-inden-1-one Openeye Name: (2E)-5-hydroxy-2-[(4-hydroxy-3,5-dimethyl-phenyl)methylene]-6-methoxy-4-nitro-indan-1-one CAS Name: (2E)-5-hydroxy-2-[(4-hydroxy-3,5-dimethylphenyl)methylidene]-6-methoxy-4-nitro-3H-inden-1-one IUPAC Name: (2E)-5-hydroxy-2-[(4-hydroxy-3,5-dimethylphenyl)methylidene]-6-methoxy-4-nitro-3H-inden-1-one Traditional Name: (2E)-5-hydroxy-2-(4-hydroxy-3,5-dimethyl-benzylidene)-6-methoxy-4-nitro-indan-1-one Formula: C19H17NO6 MolecularWeight: 355.34138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C=C2CC3=C(C(=C(C=C3C2=O)OC)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O)C)/C=C/2\CC3=C(C(=C(C=C3C2=O)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO6/c1-9-4-11(5-10(2)17(9)21)6-12-7-13-14(18(12)22)8-15(26-3)19(23)16(13)20(24)25/h4-6,8,21,23H,7H2,1-3H3/b12-6+