2-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)ethylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)ethylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-[2-(1-benzyloxycarbonyl-4-piperidyl)ethylamino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[2-(1-phenylmethoxycarbonyl-4-piperidinyl)ethylamino]propanoic acid IUPAC Name: 2-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)ethylamino]-3-sulfanylpropanoic acid Traditional Name: 2-[2-(1-carbobenzoxy-4-piperidyl)ethylamino]-3-mercapto-propionic acid Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCNC(CS)C(=O)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1CCNC(CS)C(=O)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H26N2O4S/c21-17(22)16(13-25)19-9-6-14-7-10-20(11-8-14)18(23)24-12-15-4-2-1-3-5-15/h1-5,14,16,19,25H,6-13H2,(H,21,22)