3-[(1R)-1-(4-methoxyphenyl)-2-nitro-ethyl]-6-methyl-4-oxidanylidene-pyran-2-olate

Systemtic Name: 3-[(1R)-1-(4-methoxyphenyl)-2-nitro-ethyl]-6-methyl-4-oxidanylidene-pyran-2-olate Openeye Name: 3-[(1R)-1-(4-methoxyphenyl)-2-nitro-ethyl]-6-methyl-4-oxo-pyran-2-olate CAS Name: 3-[(1R)-1-(4-methoxyphenyl)-2-nitroethyl]-6-methyl-4-oxo-2-pyranolate IUPAC Name: 3-[(1R)-1-(4-methoxyphenyl)-2-nitroethyl]-6-methyl-4-oxopyran-2-olate Traditional Name: 4-keto-3-[(1R)-1-(4-methoxyphenyl)-2-nitro-ethyl]-6-methyl-pyran-2-olate Formula: C15H14NO6- MolecularWeight: 304.27476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15NO6/c1-9-7-13(17)14(15(18)22-9)12(8-16(19)20)10-3-5-11(21-2)6-4-10/h3-7,12,18H,8H2,1-2H3/p-1/t12-/m1/s1