3-methoxy-4-(5-methylsulfanylpentoxy)aniline

Systemtic Name: 3-methoxy-4-(5-methylsulfanylpentoxy)aniline Openeye Name: 3-methoxy-4-(5-methylsulfanylpentoxy)aniline CAS Name: 3-methoxy-4-[5-(methylthio)pentoxy]aniline IUPAC Name: 3-methoxy-4-(5-methylsulfanylpentoxy)aniline Traditional Name: [3-methoxy-4-[5-(methylthio)pentoxy]phenyl]amine Formula: C13H21NO2S MolecularWeight: 255.37634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N)OCCCCCSC

Isomeric SMILES

COC1=C(C=CC(=C1)N)OCCCCCSC

InChI

InChI=1S/C13H21NO2S/c1-15-13-10-11(14)6-7-12(13)16-8-4-3-5-9-17-2/h6-7,10H,3-5,8-9,14H2,1-2H3