methyl 4-[(1R)-2-azanyl-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]ethyl]benzoate

Systemtic Name: methyl 4-[(1R)-2-azanyl-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]ethyl]benzoate Openeye Name: methyl 4-[(1R)-2-amino-1-[(2R,6S)-2,6-dimethyl-1-piperidyl]ethyl]benzoate CAS Name: 4-[(1R)-2-amino-1-[(2R,6S)-2,6-dimethyl-1-piperidinyl]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1R)-2-amino-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]ethyl]benzoate Traditional Name: 4-[(1R)-2-amino-1-[(2R,6S)-2,6-dimethylpiperidino]ethyl]benzoic acid methyl ester Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(CN)C2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1[C@@H](CN)C2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C17H26N2O2/c1-12-5-4-6-13(2)19(12)16(11-18)14-7-9-15(10-8-14)17(20)21-3/h7-10,12-13,16H,4-6,11,18H2,1-3H3/t12-,13+,16-/m0/s1