methyl (2S)-2-(3-bromophenyl)-2-[(2S)-piperidin-2-yl]ethanoate

Systemtic Name: methyl (2S)-2-(3-bromophenyl)-2-[(2S)-piperidin-2-yl]ethanoate Openeye Name: methyl (2S)-2-(3-bromophenyl)-2-[(2S)-2-piperidyl]acetate CAS Name: (2S)-2-(3-bromophenyl)-2-[(2S)-2-piperidinyl]acetic acid methyl ester IUPAC Name: methyl (2S)-2-(3-bromophenyl)-2-[(2S)-piperidin-2-yl]acetate Traditional Name: (2S)-2-(3-bromophenyl)-2-[(2S)-2-piperidyl]acetic acid methyl ester Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCCN1)C2=CC(=CC=C2)Br

Isomeric SMILES

COC(=O)[C@H]([C@@H]1CCCCN1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C14H18BrNO2/c1-18-14(17)13(12-7-2-3-8-16-12)10-5-4-6-11(15)9-10/h4-6,9,12-13,16H,2-3,7-8H2,1H3/t12-,13-/m0/s1