(E)-1-ethoxy-3-[3-methyl-2-oxidanylidene-1-(2-prop-2-enylphenyl)piperidin-3-yl]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium

Systemtic Name: (E)-1-ethoxy-3-[3-methyl-2-oxidanylidene-1-(2-prop-2-enylphenyl)piperidin-3-yl]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium Openeye Name: (E)-3-[1-(2-allylphenyl)-3-methyl-2-oxo-3-piperidyl]-1-ethoxy-1-hydroxy-3-oxo-prop-1-ene-2-diazonium CAS Name: (E)-1-ethoxy-1-hydroxy-3-[3-methyl-2-oxo-1-(2-prop-2-enylphenyl)-3-piperidinyl]-3-oxo-1-propene-2-diazonium IUPAC Name: (E)-1-ethoxy-1-hydroxy-3-[3-methyl-2-oxo-1-(2-prop-2-enylphenyl)piperidin-3-yl]-3-oxoprop-1-ene-2-diazonium Traditional Name: (E)-3-[1-(2-allylphenyl)-2-keto-3-methyl-3-piperidyl]-1-ethoxy-1-hydroxy-3-keto-prop-1-ene-2-diazonium Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C1(CCCN(C1=O)C2=CC=CC=C2CC=C)C)[N+]#N)O

Isomeric SMILES

CCO/C(=C(\C(=O)C1(CCCN(C1=O)C2=CC=CC=C2CC=C)C)/[N+]#N)/O

InChI

InChI=1S/C20H23N3O4/c1-4-9-14-10-6-7-11-15(14)23-13-8-12-20(3,19(23)26)17(24)16(22-21)18(25)27-5-2/h4,6-7,10-11H,1,5,8-9,12-13H2,2-3H3/p+1