2-azanyl-7-phenoxy-heptane-1-thiol hydrochloride

Systemtic Name: 2-azanyl-7-phenoxy-heptane-1-thiol hydrochloride Openeye Name: 2-amino-7-phenoxy-heptane-1-thiol hydrochloride CAS Name: 2-amino-7-phenoxy-1-heptanethiol hydrochloride IUPAC Name: 2-amino-7-phenoxyheptane-1-thiol hydrochloride Traditional Name: 2-amino-7-phenoxy-heptane-1-thiol hydrochloride Formula: C13H22ClNOS MolecularWeight: 275.83788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCCC(CS)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)OCCCCCC(CS)N.Cl

InChI

InChI=1S/C13H21NOS.ClH/c14-12(11-16)7-3-2-6-10-15-13-8-4-1-5-9-13;/h1,4-5,8-9,12,16H,2-3,6-7,10-11,14H2;1H