methyl 4-methoxy-1-[(2-nitrophenyl)methyl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 4-methoxy-1-[(2-nitrophenyl)methyl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 4-methoxy-1-[(2-nitrophenyl)methyl]-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-methoxy-1-[(2-nitrophenyl)methyl]-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 4-methoxy-1-[(2-nitrophenyl)methyl]-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 2-keto-4-methoxy-1-(2-nitrobenzyl)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(CC1)(CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=CC(=O)C(CC1)(CC2=CC=CC=C2[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H17NO6/c1-22-12-7-8-16(14(18)9-12,15(19)23-2)10-11-5-3-4-6-13(11)17(20)21/h3-6,9H,7-8,10H2,1-2H3