(2E)-5,7-dimethyl-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3,4-dihydronaphthalen-1-one

Systemtic Name: (2E)-5,7-dimethyl-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3,4-dihydronaphthalen-1-one Openeye Name: (2E)-2-[(4-hydroxy-3-nitro-phenyl)methylene]-5,7-dimethyl-tetralin-1-one CAS Name: (2E)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-5,7-dimethyl-3,4-dihydronaphthalen-1-one IUPAC Name: (2E)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-5,7-dimethyl-3,4-dihydronaphthalen-1-one Traditional Name: (2E)-2-(4-hydroxy-3-nitro-benzylidene)-5,7-dimethyl-tetralin-1-one Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CCC(=CC3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)C2=C1)C

Isomeric SMILES

CC1=CC(=C2CC/C(=C\C3=CC(=C(C=C3)O)[N+](=O)[O-])/C(=O)C2=C1)C

InChI

InChI=1S/C19H17NO4/c1-11-7-12(2)15-5-4-14(19(22)16(15)8-11)9-13-3-6-18(21)17(10-13)20(23)24/h3,6-10,21H,4-5H2,1-2H3/b14-9+