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

Systemtic Name: 4-[(E)-3-(3-bromophenyl)-3-oxidanylidene-prop-1-enyl]-2-nitro-phenolate Openeye Name: 4-[(E)-3-(3-bromophenyl)-3-oxo-prop-1-enyl]-2-nitro-phenolate CAS Name: 4-[(E)-3-(3-bromophenyl)-3-oxoprop-1-enyl]-2-nitrophenolate IUPAC Name: 4-[(E)-3-(3-bromophenyl)-3-oxoprop-1-enyl]-2-nitrophenolate Traditional Name: 4-[(E)-3-(3-bromophenyl)-3-keto-prop-1-enyl]-2-nitro-phenolate Formula: C15H9BrNO4- MolecularWeight: 347.14026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10BrNO4/c16-12-3-1-2-11(9-12)14(18)6-4-10-5-7-15(19)13(8-10)17(20)21/h1-9,19H/p-1/b6-4+