3-(3-chloranyl-4-methoxy-phenyl)sulfanylpropylazanium

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)sulfanylpropylazanium Openeye Name: 3-(3-chloro-4-methoxy-phenyl)sulfanylpropylammonium CAS Name: 3-[(3-chloro-4-methoxyphenyl)thio]propylammonium IUPAC Name: 3-(3-chloro-4-methoxyphenyl)sulfanylpropylazanium Traditional Name: 3-[(3-chloro-4-methoxy-phenyl)thio]propylammonium Formula: C10H15ClNOS+ MolecularWeight: 232.7502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCCC[NH3+])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)SCCC[NH3+])Cl

InChI

InChI=1S/C10H14ClNOS/c1-13-10-4-3-8(7-9(10)11)14-6-2-5-12/h3-4,7H,2,5-6,12H2,1H3/p+1