(E)-3-[butyl-(3,4-dimethoxyphenyl)amino]-2-diazonio-1-methoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (E)-3-[butyl-(3,4-dimethoxyphenyl)amino]-2-diazonio-1-methoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (E)-3-(N-butyl-3,4-dimethoxy-anilino)-2-diazonio-1-methoxy-3-oxo-prop-1-en-1-olate CAS Name: (E)-3-(N-butyl-3,4-dimethoxyanilino)-2-diazonio-1-methoxy-3-oxo-1-propen-1-olate IUPAC Name: (E)-3-(N-butyl-3,4-dimethoxyanilino)-2-diazonio-1-methoxy-3-oxoprop-1-en-1-olate Traditional Name: (E)-3-(N-butyl-3,4-dimethoxy-anilino)-2-diazonio-3-keto-1-methoxy-prop-1-en-1-olate Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC(=C(C=C1)OC)OC)C(=O)C(=C([O-])OC)[N+]#N

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O5/c1-5-6-9-19(15(20)14(18-17)16(21)24-4)11-7-8-12(22-2)13(10-11)23-3/h7-8,10H,5-6,9H2,1-4H3