N-octyl-4-octylsulfanyl-aniline hydrochloride

Systemtic Name: N-octyl-4-octylsulfanyl-aniline hydrochloride Openeye Name: N-octyl-4-octylsulfanyl-aniline hydrochloride CAS Name: N-octyl-4-(octylthio)aniline hydrochloride IUPAC Name: N-octyl-4-octylsulfanylaniline hydrochloride Traditional Name: octyl-[4-(octylthio)phenyl]amine hydrochloride Formula: C22H40ClNS MolecularWeight: 386.0777

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC=C(C=C1)SCCCCCCCC.Cl

Isomeric SMILES

CCCCCCCCNC1=CC=C(C=C1)SCCCCCCCC.Cl

InChI

InChI=1S/C22H39NS.ClH/c1-3-5-7-9-11-13-19-23-21-15-17-22(18-16-21)24-20-14-12-10-8-6-4-2;/h15-18,23H,3-14,19-20H2,1-2H3;1H