(Z)-2-diazonio-3-[2-(3,4-dimethoxyphenyl)ethyl-(5-methylhex-5-enoyl)amino]-1-ethoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-3-[2-(3,4-dimethoxyphenyl)ethyl-(5-methylhex-5-enoyl)amino]-1-ethoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-2-diazonio-3-[2-(3,4-dimethoxyphenyl)ethyl-(5-methylhex-5-enoyl)amino]-1-ethoxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-diazonio-3-[2-(3,4-dimethoxyphenyl)ethyl-(5-methyl-1-oxohex-5-enyl)amino]-1-ethoxy-3-oxo-1-propen-1-olate IUPAC Name: (Z)-2-diazonio-3-[2-(3,4-dimethoxyphenyl)ethyl-(5-methylhex-5-enoyl)amino]-1-ethoxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-2-diazonio-1-ethoxy-3-[homoveratryl(5-methylhex-5-enoyl)amino]-3-keto-prop-1-en-1-olate Formula: C22H29N3O6 MolecularWeight: 431.48216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)N(CCC1=CC(=C(C=C1)OC)OC)C(=O)CCCC(=C)C)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(/C(=O)N(CCC1=CC(=C(C=C1)OC)OC)C(=O)CCCC(=C)C)\[N+]#N)/[O-]

InChI

InChI=1S/C22H29N3O6/c1-6-31-22(28)20(24-23)21(27)25(19(26)9-7-8-15(2)3)13-12-16-10-11-17(29-4)18(14-16)30-5/h10-11,14H,2,6-9,12-13H2,1,3-5H3