[2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] benzoate

Systemtic Name: [2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] benzoate Openeye Name: [2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] benzoate CAS Name: benzoic acid [2-(dimethylaminomethyl)-1-ethylcyclohexyl] ester IUPAC Name: [2-(dimethylaminomethyl)-1-ethylcyclohexyl] benzoate Traditional Name: benzoic acid [2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] ester Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCC1CN(C)C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC1(CCCCC1CN(C)C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H27NO2/c1-4-18(13-9-8-12-16(18)14-19(2)3)21-17(20)15-10-6-5-7-11-15/h5-7,10-11,16H,4,8-9,12-14H2,1-3H3