2-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[(1-benzyl-4-piperidyl)amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-[[1-(phenylmethyl)-4-piperidinyl]amino]ethyl]thio]acetic acid IUPAC Name: 2-[2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[(1-benzyl-4-piperidyl)amino]-2-keto-ethyl]thio]acetic acid Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CSCC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1NC(=O)CSCC(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O3S/c19-15(11-22-12-16(20)21)17-14-6-8-18(9-7-14)10-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,17,19)(H,20,21)