2-nitro-6-[(E)-3-oxidanylidene-3-(4-phenylphenyl)prop-1-enyl]phenolate

Systemtic Name: 2-nitro-6-[(E)-3-oxidanylidene-3-(4-phenylphenyl)prop-1-enyl]phenolate Openeye Name: 2-nitro-6-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenolate CAS Name: 2-nitro-6-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenolate IUPAC Name: 2-nitro-6-[(E)-3-oxo-3-(4-phenylphenyl)prop-1-enyl]phenolate Traditional Name: 2-[(E)-3-keto-3-(4-phenylphenyl)prop-1-enyl]-6-nitro-phenolate Formula: C21H14NO4- MolecularWeight: 344.34016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15NO4/c23-20(14-13-18-7-4-8-19(21(18)24)22(25)26)17-11-9-16(10-12-17)15-5-2-1-3-6-15/h1-14,24H/p-1/b14-13+