[1-butyl-2-(dimethylaminomethyl)cyclohexyl] 2-phenylethanoate

Systemtic Name: [1-butyl-2-(dimethylaminomethyl)cyclohexyl] 2-phenylethanoate Openeye Name: [1-butyl-2-(dimethylaminomethyl)cyclohexyl] 2-phenylacetate CAS Name: 2-phenylacetic acid [1-butyl-2-(dimethylaminomethyl)cyclohexyl] ester IUPAC Name: [1-butyl-2-(dimethylaminomethyl)cyclohexyl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [1-butyl-2-(dimethylaminomethyl)cyclohexyl] ester Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCCCC1CN(C)C)OC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCC1(CCCCC1CN(C)C)OC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H33NO2/c1-4-5-14-21(15-10-9-13-19(21)17-22(2)3)24-20(23)16-18-11-7-6-8-12-18/h6-8,11-12,19H,4-5,9-10,13-17H2,1-3H3