6-methyl-3-[(E)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enoyl]-4-oxidanylidene-pyran-2-olate

Systemtic Name: 6-methyl-3-[(E)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enoyl]-4-oxidanylidene-pyran-2-olate Openeye Name: 3-[(E)-3-(4-hydroxy-3-nitro-phenyl)prop-2-enoyl]-6-methyl-4-oxo-pyran-2-olate CAS Name: 3-[(E)-3-(4-hydroxy-3-nitrophenyl)-1-oxoprop-2-enyl]-6-methyl-4-oxo-2-pyranolate IUPAC Name: 3-[(E)-3-(4-hydroxy-3-nitrophenyl)prop-2-enoyl]-6-methyl-4-oxopyran-2-olate Traditional Name: 3-[(E)-3-(4-hydroxy-3-nitro-phenyl)acryloyl]-4-keto-6-methyl-pyran-2-olate Formula: C15H10NO7- MolecularWeight: 316.2424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11NO7/c1-8-6-13(19)14(15(20)23-8)12(18)5-3-9-2-4-11(17)10(7-9)16(21)22/h2-7,17,20H,1H3/p-1/b5-3+