[[(E)-3-[4-(2-azaniumylethoxy)phenyl]prop-2-enyl]sulfanyl-azanyl-methylidene]azanium

Systemtic Name: [[(E)-3-[4-(2-azaniumylethoxy)phenyl]prop-2-enyl]sulfanyl-azanyl-methylidene]azanium Openeye Name: [amino-[(E)-3-[4-(2-azaniumylethoxy)phenyl]allyl]sulfanyl-methylene]ammonium CAS Name: [amino-[[(E)-3-[4-(2-ammonioethoxy)phenyl]prop-2-enyl]thio]methylidene]ammonium IUPAC Name: [amino-[(E)-3-[4-(2-azaniumylethoxy)phenyl]prop-2-enyl]sulfanylmethylidene]azanium Traditional Name: [amino-[[(E)-3-[4-(2-ammonioethoxy)phenyl]allyl]thio]methylene]ammonium Formula: C12H19N3OS+2 MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CCSC(=[NH2+])N)OCC[NH3+]

Isomeric SMILES

C1=CC(=CC=C1/C=C/CSC(=[NH2+])N)OCC[NH3+]

InChI

InChI=1S/C12H17N3OS/c13-7-8-16-11-5-3-10(4-6-11)2-1-9-17-12(14)15/h1-6H,7-9,13H2,(H3,14,15)/p+2/b2-1+