[2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride

Systemtic Name: [2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride Openeye Name: [2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride CAS Name: (E)-3-phenyl-2-propenoic acid [2-(dimethylaminomethyl)-1-ethylcyclohexyl] ester hydrochloride IUPAC Name: [2-(dimethylaminomethyl)-1-ethylcyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride Traditional Name: (E)-3-phenylacrylic acid [2-(dimethylaminomethyl)-1-ethyl-cyclohexyl] ester hydrochloride Formula: C20H30ClNO2 MolecularWeight: 351.9107

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCC1CN(C)C)OC(=O)C=CC2=CC=CC=C2.Cl

Isomeric SMILES

CCC1(CCCCC1CN(C)C)OC(=O)/C=C/C2=CC=CC=C2.Cl

InChI

InChI=1S/C20H29NO2.ClH/c1-4-20(15-9-8-12-18(20)16-21(2)3)23-19(22)14-13-17-10-6-5-7-11-17;/h5-7,10-11,13-14,18H,4,8-9,12,15-16H2,1-3H3;1H/b14-13+;