[1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-oxidanylidene-pyridin-3-yl] ethanoate

Systemtic Name: [1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-oxidanylidene-pyridin-3-yl] ethanoate Openeye Name: [1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-2-oxo-3-pyridyl] acetate CAS Name: acetic acid [1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-2-oxo-3-pyridinyl] ester IUPAC Name: [1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)-2-oxopyridin-3-yl] acetate Traditional Name: acetic acid [1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-2-keto-3-pyridyl] ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CN(C1=O)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CC(=O)OC1=CC=CN(C1=O)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O

InChI

InChI=1S/C18H18N2O7/c1-10(21)26-14-5-4-8-19(17(14)23)15-12-9-11(20(24)25)6-7-13(12)27-18(2,3)16(15)22/h4-9,15-16,22H,1-3H3