(Z)-1-but-3-enoxy-2-diazonio-3-(3,3-dimethyl-2-sulfanylidene-indol-1-yl)-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-1-but-3-enoxy-2-diazonio-3-(3,3-dimethyl-2-sulfanylidene-indol-1-yl)-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-1-but-3-enoxy-2-diazonio-3-(3,3-dimethyl-2-thioxo-indolin-1-yl)-3-oxo-prop-1-en-1-olate CAS Name: (Z)-1-but-3-enoxy-2-diazonio-3-(3,3-dimethyl-2-sulfanylidene-1-indolyl)-3-oxo-1-propen-1-olate IUPAC Name: (Z)-1-but-3-enoxy-2-diazonio-3-(3,3-dimethyl-2-sulfanylideneindol-1-yl)-3-oxoprop-1-en-1-olate Traditional Name: (Z)-1-but-3-enoxy-2-diazonio-3-(3,3-dimethyl-2-thioxo-indolin-1-yl)-3-keto-prop-1-en-1-olate Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=S)C(=O)C(=C([O-])OCCC=C)[N+]#N)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=S)C(=O)/C(=C(\[O-])/OCCC=C)/[N+]#N)C

InChI

InChI=1S/C17H17N3O3S/c1-4-5-10-23-15(22)13(19-18)14(21)20-12-9-7-6-8-11(12)17(2,3)16(20)24/h4,6-9H,1,5,10H2,2-3H3