(E)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-1-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)-1-(p-tolyl)prop-2-en-1-one Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)OC)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO5/c1-11-3-6-13(7-4-11)15(19)8-5-12-9-14(18(21)22)17(20)16(10-12)23-2/h3-10,20H,1-2H3/b8-5+