methyl (E)-7-[3-(2-nitropropyl)-2-bicyclo[2.2.1]hept-5-enyl]hept-5-enoate

Systemtic Name: methyl (E)-7-[3-(2-nitropropyl)-2-bicyclo[2.2.1]hept-5-enyl]hept-5-enoate Openeye Name: methyl (E)-7-[3-(2-nitropropyl)-2-bicyclo[2.2.1]hept-5-enyl]hept-5-enoate CAS Name: (E)-7-[3-(2-nitropropyl)-2-bicyclo[2.2.1]hept-5-enyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[3-(2-nitropropyl)-2-bicyclo[2.2.1]hept-5-enyl]hept-5-enoate Traditional Name: (E)-7-[3-(2-nitropropyl)-2-bicyclo[2.2.1]hept-5-enyl]hept-5-enoic acid methyl ester Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1C2CC(C1CC=CCCCC(=O)OC)C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(CC1C2CC(C1C/C=C/CCCC(=O)OC)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H27NO4/c1-13(19(21)22)11-17-15-10-9-14(12-15)16(17)7-5-3-4-6-8-18(20)23-2/h3,5,9-10,13-17H,4,6-8,11-12H2,1-2H3/b5-3+