methane; 3-[1-propyl-5-(sulfanylmethyl)piperidin-3-yl]phenol

Systemtic Name: methane; 3-[1-propyl-5-(sulfanylmethyl)piperidin-3-yl]phenol Openeye Name: methane; 3-[1-propyl-5-(sulfanylmethyl)-3-piperidyl]phenol CAS Name: 3-[5-(mercaptomethyl)-1-propyl-3-piperidinyl]phenol; methane IUPAC Name: methane; 3-[1-propyl-5-(sulfanylmethyl)piperidin-3-yl]phenol Traditional Name: 3-[5-(mercaptomethyl)-1-propyl-3-piperidyl]phenol; methane Formula: C16H27NOS MolecularWeight: 281.45668

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Descriptors Computed from Structure

Canonical SMILES:

C.CCCN1CC(CC(C1)C2=CC(=CC=C2)O)CS

Isomeric SMILES

C.CCCN1CC(CC(C1)C2=CC(=CC=C2)O)CS

InChI

InChI=1S/C15H23NOS.CH4/c1-2-6-16-9-12(11-18)7-14(10-16)13-4-3-5-15(17)8-13;/h3-5,8,12,14,17-18H,2,6-7,9-11H2,1H3;1H4