[(1S,2S)-2-(dimethylaminomethyl)cyclohexyl] (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [(1S,2S)-2-(dimethylaminomethyl)cyclohexyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [(1S,2S)-2-(dimethylaminomethyl)cyclohexyl] (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid [(1S,2S)-2-(dimethylaminomethyl)cyclohexyl] ester IUPAC Name: [(1S,2S)-2-(dimethylaminomethyl)cyclohexyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid [(1S,2S)-2-(dimethylaminomethyl)cyclohexyl] ester Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCCC1OC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CN(C)C[C@@H]1CCCC[C@@H]1OC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H27NO3/c1-20(2)14-16-6-4-5-7-18(16)23-19(21)13-10-15-8-11-17(22-3)12-9-15/h8-13,16,18H,4-7,14H2,1-3H3/b13-10+/t16-,18-/m0/s1