(Z)-1-ethoxy-3-[3-[(2-methylphenyl)amino]-5-phenyl-thiophen-2-yl]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium

Systemtic Name: (Z)-1-ethoxy-3-[3-[(2-methylphenyl)amino]-5-phenyl-thiophen-2-yl]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium Openeye Name: (Z)-1-ethoxy-1-hydroxy-3-[3-(2-methylanilino)-5-phenyl-2-thienyl]-3-oxo-prop-1-ene-2-diazonium CAS Name: (Z)-1-ethoxy-1-hydroxy-3-[3-(2-methylanilino)-5-phenyl-2-thiophenyl]-3-oxo-1-propene-2-diazonium IUPAC Name: (Z)-1-ethoxy-1-hydroxy-3-[3-(2-methylanilino)-5-phenylthiophen-2-yl]-3-oxoprop-1-ene-2-diazonium Traditional Name: (Z)-1-ethoxy-1-hydroxy-3-keto-3-[3-(o-toluidino)-5-phenyl-2-thienyl]prop-1-ene-2-diazonium Formula: C22H20N3O3S+ MolecularWeight: 406.4775

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC3=CC=CC=C3C)[N+]#N)O

Isomeric SMILES

CCO/C(=C(/C(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC3=CC=CC=C3C)\[N+]#N)/O

InChI

InChI=1S/C22H19N3O3S/c1-3-28-22(27)19(25-23)20(26)21-17(24-16-12-8-7-9-14(16)2)13-18(29-21)15-10-5-4-6-11-15/h4-13H,3H2,1-2H3,(H-,24,26,27)/p+1