[(1R,2R)-1-ethanoyl-2-methoxycarbonyl-cyclohex-3-en-1-yl] 4-nitrobenzoate

Systemtic Name: [(1R,2R)-1-ethanoyl-2-methoxycarbonyl-cyclohex-3-en-1-yl] 4-nitrobenzoate Openeye Name: [(1R,2R)-1-acetyl-2-methoxycarbonyl-cyclohex-3-en-1-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1R,2R)-1-acetyl-2-methoxycarbonyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1R,2R)-1-acetyl-2-methoxycarbonylcyclohex-3-en-1-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1R,2R)-1-acetyl-2-carbomethoxy-cyclohex-3-en-1-yl] ester Formula: C17H17NO7 MolecularWeight: 347.31938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCC=CC1C(=O)OC)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)[C@]1(CCC=C[C@H]1C(=O)OC)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17NO7/c1-11(19)17(10-4-3-5-14(17)16(21)24-2)25-15(20)12-6-8-13(9-7-12)18(22)23/h3,5-9,14H,4,10H2,1-2H3/t14-,17-/m0/s1