methyl 4-[(1R)-2-azanyl-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethyl]benzoate

Systemtic Name: methyl 4-[(1R)-2-azanyl-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethyl]benzoate Openeye Name: methyl 4-[(1R)-2-amino-1-[(3R,5R)-3,5-dimethyl-1-piperidyl]ethyl]benzoate CAS Name: 4-[(1R)-2-amino-1-[(3R,5R)-3,5-dimethyl-1-piperidinyl]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1R)-2-amino-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethyl]benzoate Traditional Name: 4-[(1R)-2-amino-1-[(3R,5R)-3,5-dimethylpiperidino]ethyl]benzoic acid methyl ester Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(CN)C2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)[C@@H](CN)C2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C17H26N2O2/c1-12-8-13(2)11-19(10-12)16(9-18)14-4-6-15(7-5-14)17(20)21-3/h4-7,12-13,16H,8-11,18H2,1-3H3/t12-,13-,16+/m1/s1