[4-(sulfanylmethyl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-(sulfanylmethyl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-(sulfanylmethyl)-1-piperidyl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-(mercaptomethyl)-1-piperidinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-(sulfanylmethyl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [4-(mercaptomethyl)piperidino]-(3,4,5-trimethoxyphenyl)methanone Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)CS

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)CS

InChI

InChI=1S/C16H23NO4S/c1-19-13-8-12(9-14(20-2)15(13)21-3)16(18)17-6-4-11(10-22)5-7-17/h8-9,11,22H,4-7,10H2,1-3H3