methyl 1-[2-(3,5-dimethylphenoxy)ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-(3,5-dimethylphenoxy)ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-(3,5-dimethylphenoxy)ethyl]-5-nitro-2-oxo-pyridine-3-carboxylate CAS Name: 1-[2-(3,5-dimethylphenoxy)ethyl]-5-nitro-2-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3,5-dimethylphenoxy)ethyl]-5-nitro-2-oxopyridine-3-carboxylate Traditional Name: 1-[2-(3,5-dimethylphenoxy)ethyl]-2-keto-5-nitro-nicotinic acid methyl ester Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN2C=C(C=C(C2=O)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN2C=C(C=C(C2=O)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O6/c1-11-6-12(2)8-14(7-11)25-5-4-18-10-13(19(22)23)9-15(16(18)20)17(21)24-3/h6-10H,4-5H2,1-3H3