[2-(4-methoxyphenyl)sulfanylphenyl]methyl-dipropyl-azanium

Systemtic Name: [2-(4-methoxyphenyl)sulfanylphenyl]methyl-dipropyl-azanium Openeye Name: [2-(4-methoxyphenyl)sulfanylphenyl]methyl-dipropyl-ammonium CAS Name: [2-[(4-methoxyphenyl)thio]phenyl]methyl-dipropylammonium IUPAC Name: [2-(4-methoxyphenyl)sulfanylphenyl]methyl-dipropylazanium Traditional Name: [2-[(4-methoxyphenyl)thio]benzyl]-dipropyl-ammonium Formula: C20H28NOS+ MolecularWeight: 330.50742

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC1=CC=CC=C1SC2=CC=C(C=C2)OC

Isomeric SMILES

CCC[NH+](CCC)CC1=CC=CC=C1SC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H27NOS/c1-4-14-21(15-5-2)16-17-8-6-7-9-20(17)23-19-12-10-18(22-3)11-13-19/h6-13H,4-5,14-16H2,1-3H3/p+1