[7-[(4-methylsulfanylphenyl)amino]-7-oxidanylidene-heptyl]azanium

Systemtic Name: [7-[(4-methylsulfanylphenyl)amino]-7-oxidanylidene-heptyl]azanium Openeye Name: [7-(4-methylsulfanylanilino)-7-oxo-heptyl]ammonium CAS Name: [7-[4-(methylthio)anilino]-7-oxoheptyl]ammonium IUPAC Name: [7-(4-methylsulfanylanilino)-7-oxoheptyl]azanium Traditional Name: [7-keto-7-[4-(methylthio)anilino]heptyl]ammonium Formula: C14H23N2OS+ MolecularWeight: 267.41022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CCCCCC[NH3+]

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CCCCCC[NH3+]

InChI

InChI=1S/C14H22N2OS/c1-18-13-9-7-12(8-10-13)16-14(17)6-4-2-3-5-11-15/h7-10H,2-6,11,15H2,1H3,(H,16,17)/p+1