methyl 1-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(1,3-benzoxazol-2-ylthio)acetyl]isonipecotic acid methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C16H18N2O4S/c1-21-15(20)11-6-8-18(9-7-11)14(19)10-23-16-17-12-4-2-3-5-13(12)22-16/h2-5,11H,6-10H2,1H3