[azanyl-[(3-chloranyl-4-hexoxy-phenyl)methylsulfanyl]methylidene]azanium

Systemtic Name: [azanyl-[(3-chloranyl-4-hexoxy-phenyl)methylsulfanyl]methylidene]azanium Openeye Name: [amino-[(3-chloro-4-hexoxy-phenyl)methylsulfanyl]methylene]ammonium CAS Name: [amino-[(3-chloro-4-hexoxyphenyl)methylthio]methylidene]ammonium IUPAC Name: [amino-[(3-chloro-4-hexoxyphenyl)methylsulfanyl]methylidene]azanium Traditional Name: [amino-[(3-chloro-4-hexoxy-benzyl)thio]methylene]ammonium Formula: C14H22ClN2OS+ MolecularWeight: 301.85528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)CSC(=[NH2+])N)Cl

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)CSC(=[NH2+])N)Cl

InChI

InChI=1S/C14H21ClN2OS/c1-2-3-4-5-8-18-13-7-6-11(9-12(13)15)10-19-14(16)17/h6-7,9H,2-5,8,10H2,1H3,(H3,16,17)/p+1