(1-methoxycarbonyl-3-methyl-cyclohex-3-en-1-yl) 4-nitrobenzoate

Systemtic Name: (1-methoxycarbonyl-3-methyl-cyclohex-3-en-1-yl) 4-nitrobenzoate Openeye Name: (1-methoxycarbonyl-3-methyl-cyclohex-3-en-1-yl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (1-methoxycarbonyl-3-methyl-1-cyclohex-3-enyl) ester IUPAC Name: (1-methoxycarbonyl-3-methylcyclohex-3-en-1-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (1-carbomethoxy-3-methyl-cyclohex-3-en-1-yl) ester Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO6/c1-11-4-3-9-16(10-11,15(19)22-2)23-14(18)12-5-7-13(8-6-12)17(20)21/h4-8H,3,9-10H2,1-2H3