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

Systemtic Name: [(E)-2-methoxycarbonyl-4-methyl-pent-2-enyl] 4-nitrobenzoate Openeye Name: [(E)-2-methoxycarbonyl-4-methyl-pent-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-2-methoxycarbonyl-4-methylpent-2-enyl] ester IUPAC Name: [(E)-2-methoxycarbonyl-4-methylpent-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-2-carbomethoxy-4-methyl-pent-2-enyl] ester Formula: C15H17NO6 MolecularWeight: 307.29858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO6/c1-10(2)8-12(14(17)21-3)9-22-15(18)11-4-6-13(7-5-11)16(19)20/h4-8,10H,9H2,1-3H3/b12-8+