2-azanyl-2-(1-phenyl-4-sulfanyl-piperidin-4-yl)ethanoic acid

Systemtic Name: 2-azanyl-2-(1-phenyl-4-sulfanyl-piperidin-4-yl)ethanoic acid Openeye Name: 2-amino-2-(1-phenyl-4-sulfanyl-4-piperidyl)acetic acid CAS Name: 2-amino-2-(4-mercapto-1-phenyl-4-piperidinyl)acetic acid IUPAC Name: 2-amino-2-(1-phenyl-4-sulfanylpiperidin-4-yl)acetic acid Traditional Name: 2-amino-2-(4-mercapto-1-phenyl-4-piperidyl)acetic acid Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(C(=O)O)N)S)C2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1(C(C(=O)O)N)S)C2=CC=CC=C2

InChI

InChI=1S/C13H18N2O2S/c14-11(12(16)17)13(18)6-8-15(9-7-13)10-4-2-1-3-5-10/h1-5,11,18H,6-9,14H2,(H,16,17)