methyl (2S)-2-(2-bromophenyl)-2-piperidin-2-yl-ethanoate hydrochloride

Systemtic Name: methyl (2S)-2-(2-bromophenyl)-2-piperidin-2-yl-ethanoate hydrochloride Openeye Name: methyl (2S)-2-(2-bromophenyl)-2-(2-piperidyl)acetate hydrochloride CAS Name: (2S)-2-(2-bromophenyl)-2-(2-piperidinyl)acetic acid methyl ester hydrochloride IUPAC Name: methyl (2S)-2-(2-bromophenyl)-2-piperidin-2-ylacetate hydrochloride Traditional Name: (2S)-2-(2-bromophenyl)-2-(2-piperidyl)acetic acid methyl ester hydrochloride Formula: C14H19BrClNO2 MolecularWeight: 348.66316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCCN1)C2=CC=CC=C2Br.Cl

Isomeric SMILES

COC(=O)[C@H](C1CCCCN1)C2=CC=CC=C2Br.Cl

InChI

InChI=1S/C14H18BrNO2.ClH/c1-18-14(17)13(12-8-4-5-9-16-12)10-6-2-3-7-11(10)15;/h2-3,6-7,12-13,16H,4-5,8-9H2,1H3;1H/t12?,13-;/m0./s1