4-[(E)-3-(2-methoxy-5-methyl-phenyl)-3-oxidanylidene-prop-1-enyl]-2-nitro-phenolate

Systemtic Name: 4-[(E)-3-(2-methoxy-5-methyl-phenyl)-3-oxidanylidene-prop-1-enyl]-2-nitro-phenolate Openeye Name: 4-[(E)-3-(2-methoxy-5-methyl-phenyl)-3-oxo-prop-1-enyl]-2-nitro-phenolate CAS Name: 4-[(E)-3-(2-methoxy-5-methylphenyl)-3-oxoprop-1-enyl]-2-nitrophenolate IUPAC Name: 4-[(E)-3-(2-methoxy-5-methylphenyl)-3-oxoprop-1-enyl]-2-nitrophenolate Traditional Name: 4-[(E)-3-keto-3-(2-methoxy-5-methyl-phenyl)prop-1-enyl]-2-nitro-phenolate Formula: C17H14NO5- MolecularWeight: 312.29676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO5/c1-11-3-8-17(23-2)13(9-11)15(19)6-4-12-5-7-16(20)14(10-12)18(21)22/h3-10,20H,1-2H3/p-1/b6-4+