1-phenylmethoxycarbonylpiperidine-4-carbothioic S-acid

Systemtic Name: 1-phenylmethoxycarbonylpiperidine-4-carbothioic S-acid Openeye Name: 1-benzyloxycarbonylpiperidine-4-carbothioic S-acid CAS Name: 1-phenylmethoxycarbonyl-4-piperidinecarbothioic S-acid IUPAC Name: 1-phenylmethoxycarbonylpiperidine-4-carbothioic S-acid Traditional Name: 1-carbobenzoxythioisonipecotic acid Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)S)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1C(=O)S)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H17NO3S/c16-13(19)12-6-8-15(9-7-12)14(17)18-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H,16,19)