pentyl 4-[4-(4-heptylcyclohexyl)cyclohexyl]-1-methyl-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: pentyl 4-[4-(4-heptylcyclohexyl)cyclohexyl]-1-methyl-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: pentyl 4-[4-(4-heptylcyclohexyl)cyclohexyl]-1-methyl-2-oxo-cyclohexanecarboxylate CAS Name: 4-[4-(4-heptylcyclohexyl)cyclohexyl]-1-methyl-2-oxo-1-cyclohexanecarboxylic acid pentyl ester IUPAC Name: pentyl 4-[4-(4-heptylcyclohexyl)cyclohexyl]-1-methyl-2-oxocyclohexane-1-carboxylate Traditional Name: 4-[4-(4-heptylcyclohexyl)cyclohexyl]-2-keto-1-methyl-cyclohexanecarboxylic acid amyl ester Formula: C32H56O3 MolecularWeight: 488.78524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C3CCC(C(=O)C3)(C)C(=O)OCCCCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C3CCC(C(=O)C3)(C)C(=O)OCCCCC

InChI

InChI=1S/C32H56O3/c1-4-6-8-9-10-12-25-13-15-26(16-14-25)27-17-19-28(20-18-27)29-21-22-32(3,30(33)24-29)31(34)35-23-11-7-5-2/h25-29H,4-24H2,1-3H3