ethyl (1S,2R)-2-[bis(trideuteriomethyl)amino]-1-phenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,2R)-2-[bis(trideuteriomethyl)amino]-1-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,2R)-2-[bis(trideuteriomethyl)amino]-1-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,2R)-2-[bis(trideuteriomethyl)amino]-1-phenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R)-2-[bis(trideuteriomethyl)amino]-1-phenylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,2R)-2-[bis(trideuteriomethyl)amino]-1-phenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C17H23NO2 MolecularWeight: 279.406991

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC=CC1N(C)C)C2=CC=CC=C2

Isomeric SMILES

[2H]C([2H])([2H])N([C@@H]1C=CCC[C@@]1(C2=CC=CC=C2)C(=O)OCC)C([2H])([2H])[2H]

InChI

InChI=1S/C17H23NO2/c1-4-20-16(19)17(14-10-6-5-7-11-14)13-9-8-12-15(17)18(2)3/h5-8,10-12,15H,4,9,13H2,1-3H3/t15-,17+/m1/s1/i2D3,3D3