3-oxidanylidene-4-phenyl-1-prop-2-enoxy-1-sulfanyl-but-1-ene-2-diazonium

Systemtic Name: 3-oxidanylidene-4-phenyl-1-prop-2-enoxy-1-sulfanyl-but-1-ene-2-diazonium Openeye Name: 1-allyloxy-3-oxo-4-phenyl-1-sulfanyl-but-1-ene-2-diazonium CAS Name: 1-mercapto-3-oxo-4-phenyl-1-prop-2-enoxy-1-butene-2-diazonium IUPAC Name: 3-oxo-4-phenyl-1-prop-2-enoxy-1-sulfanylbut-1-ene-2-diazonium Traditional Name: 1-allyloxy-3-keto-1-mercapto-4-phenyl-but-1-ene-2-diazonium Formula: C13H13N2O2S+ MolecularWeight: 261.31952

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=C(C(=O)CC1=CC=CC=C1)[N+]#N)S

Isomeric SMILES

C=CCOC(=C(C(=O)CC1=CC=CC=C1)[N+]#N)S

InChI

InChI=1S/C13H12N2O2S/c1-2-8-17-13(18)12(15-14)11(16)9-10-6-4-3-5-7-10/h2-7H,1,8-9H2/p+1