7-[2-(4,4-dimethyl-3-oxidanyl-octyl)-5-oxidanylidene-cyclopent-3-en-1-yl]heptyl N-methylcarbamate

Systemtic Name: 7-[2-(4,4-dimethyl-3-oxidanyl-octyl)-5-oxidanylidene-cyclopent-3-en-1-yl]heptyl N-methylcarbamate Openeye Name: 7-[2-(3-hydroxy-4,4-dimethyl-octyl)-5-oxo-cyclopent-3-en-1-yl]heptyl N-methylcarbamate CAS Name: N-methylcarbamic acid 7-[2-(3-hydroxy-4,4-dimethyloctyl)-5-oxo-1-cyclopent-3-enyl]heptyl ester IUPAC Name: 7-[2-(3-hydroxy-4,4-dimethyloctyl)-5-oxocyclopent-3-en-1-yl]heptyl N-methylcarbamate Traditional Name: N-methylcarbamic acid 7-[2-(3-hydroxy-4,4-dimethyl-octyl)-5-keto-cyclopent-3-en-1-yl]heptyl ester Formula: C24H43NO4 MolecularWeight: 409.60252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CCC1C=CC(=O)C1CCCCCCCOC(=O)NC)O

Isomeric SMILES

CCCCC(C)(C)C(CCC1C=CC(=O)C1CCCCCCCOC(=O)NC)O

InChI

InChI=1S/C24H43NO4/c1-5-6-17-24(2,3)22(27)16-14-19-13-15-21(26)20(19)12-10-8-7-9-11-18-29-23(28)25-4/h13,15,19-20,22,27H,5-12,14,16-18H2,1-4H3,(H,25,28)