[4-acetyloxy-3,4-bis[2-(dicyclohexylamino)ethyl]-1,3-dimethyl-cyclohexyl] ethanoate

Systemtic Name: [4-acetyloxy-3,4-bis[2-(dicyclohexylamino)ethyl]-1,3-dimethyl-cyclohexyl] ethanoate Openeye Name: [4-acetoxy-3,4-bis[2-(dicyclohexylamino)ethyl]-1,3-dimethyl-cyclohexyl] acetate CAS Name: acetic acid [4-acetyloxy-3,4-bis[2-(dicyclohexylamino)ethyl]-1,3-dimethylcyclohexyl] ester IUPAC Name: [4-acetyloxy-3,4-bis[2-(dicyclohexylamino)ethyl]-1,3-dimethylcyclohexyl] acetate Traditional Name: acetic acid [4-acetoxy-3,4-bis[2-(dicyclohexylamino)ethyl]-1,3-dimethyl-cyclohexyl] ester Formula: C40H70N2O4 MolecularWeight: 642.9948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCC(C(C1)(C)CCN(C2CCCCC2)C3CCCCC3)(CCN(C4CCCCC4)C5CCCCC5)OC(=O)C)C

Isomeric SMILES

CC(=O)OC1(CCC(C(C1)(C)CCN(C2CCCCC2)C3CCCCC3)(CCN(C4CCCCC4)C5CCCCC5)OC(=O)C)C

InChI

InChI=1S/C40H70N2O4/c1-32(43)45-39(4)25-26-40(46-33(2)44,28-30-42(36-21-13-7-14-22-36)37-23-15-8-16-24-37)38(3,31-39)27-29-41(34-17-9-5-10-18-34)35-19-11-6-12-20-35/h34-37H,5-31H2,1-4H3