dodecyl 1-aminocarbonyl-2-(3-hexyl-4-oxidanylidene-oxetan-2-yl)-2-methyl-cyclohexane-1-carboxylate

Systemtic Name: dodecyl 1-aminocarbonyl-2-(3-hexyl-4-oxidanylidene-oxetan-2-yl)-2-methyl-cyclohexane-1-carboxylate Openeye Name: dodecyl 1-carbamoyl-2-(3-hexyl-4-oxo-oxetan-2-yl)-2-methyl-cyclohexanecarboxylate CAS Name: 1-carbamoyl-2-(3-hexyl-4-oxo-2-oxetanyl)-2-methyl-1-cyclohexanecarboxylic acid dodecyl ester IUPAC Name: dodecyl 1-carbamoyl-2-(3-hexyl-4-oxooxetan-2-yl)-2-methylcyclohexane-1-carboxylate Traditional Name: 1-carbamoyl-2-(3-hexyl-4-keto-oxetan-2-yl)-2-methyl-cyclohexanecarboxylic acid lauryl ester Formula: C30H53NO5 MolecularWeight: 507.74552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1(CCCCC1(C)C2C(C(=O)O2)CCCCCC)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1(CCCCC1(C)C2C(C(=O)O2)CCCCCC)C(=O)N

InChI

InChI=1S/C30H53NO5/c1-4-6-8-10-11-12-13-14-15-19-23-35-28(34)30(27(31)33)22-18-17-21-29(30,3)25-24(26(32)36-25)20-16-9-7-5-2/h24-25H,4-23H2,1-3H3,(H2,31,33)