2-methoxy-4-[(E)-3-(5-methylfuran-2-yl)-3-oxidanylidene-prop-1-enyl]-6-nitro-phenolate

Systemtic Name: 2-methoxy-4-[(E)-3-(5-methylfuran-2-yl)-3-oxidanylidene-prop-1-enyl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[(E)-3-(5-methyl-2-furyl)-3-oxo-prop-1-enyl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[(E)-3-(5-methyl-2-furanyl)-3-oxoprop-1-enyl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(E)-3-(5-methylfuran-2-yl)-3-oxoprop-1-enyl]-6-nitrophenolate Traditional Name: 4-[(E)-3-keto-3-(5-methyl-2-furyl)prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C15H12NO6- MolecularWeight: 302.25888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)C=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H13NO6/c1-9-3-6-13(22-9)12(17)5-4-10-7-11(16(19)20)15(18)14(8-10)21-2/h3-8,18H,1-2H3/p-1/b5-4+