methyl 3-[(3R,4R)-3,4-dimethyl-1-phenethyl-piperidin-4-yl]benzoate

Systemtic Name: methyl 3-[(3R,4R)-3,4-dimethyl-1-phenethyl-piperidin-4-yl]benzoate Openeye Name: methyl 3-[(3R,4R)-3,4-dimethyl-1-phenethyl-4-piperidyl]benzoate CAS Name: 3-[(3R,4R)-3,4-dimethyl-1-phenethyl-4-piperidinyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(3R,4R)-3,4-dimethyl-1-phenethylpiperidin-4-yl]benzoate Traditional Name: 3-[(3R,4R)-3,4-dimethyl-1-phenethyl-4-piperidyl]benzoic acid methyl ester Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1(C)C2=CC=CC(=C2)C(=O)OC)CCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CN(CC[C@@]1(C)C2=CC=CC(=C2)C(=O)OC)CCC3=CC=CC=C3

InChI

InChI=1S/C23H29NO2/c1-18-17-24(14-12-19-8-5-4-6-9-19)15-13-23(18,2)21-11-7-10-20(16-21)22(25)26-3/h4-11,16,18H,12-15,17H2,1-3H3/t18-,23+/m0/s1