[(E)-2-methoxycarbonyl-4,4-dimethyl-pent-2-enyl] 4-nitrobenzoate

Systemtic Name: [(E)-2-methoxycarbonyl-4,4-dimethyl-pent-2-enyl] 4-nitrobenzoate Openeye Name: [(E)-2-methoxycarbonyl-4,4-dimethyl-pent-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-2-methoxycarbonyl-4,4-dimethylpent-2-enyl] ester IUPAC Name: [(E)-2-methoxycarbonyl-4,4-dimethylpent-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-2-carbomethoxy-4,4-dimethyl-pent-2-enyl] ester Formula: C16H19NO6 MolecularWeight: 321.32516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=C(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)/C=C(\COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)OC

InChI

InChI=1S/C16H19NO6/c1-16(2,3)9-12(14(18)22-4)10-23-15(19)11-5-7-13(8-6-11)17(20)21/h5-9H,10H2,1-4H3/b12-9+