(Z)-2-diazonio-3-[4-(2-ethenylphenyl)-5-ethoxycarbonyl-6-methyl-2-oxidanylidene-1-(phenylmethyl)-4H-pyrimidin-3-yl]-1-methoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-3-[4-(2-ethenylphenyl)-5-ethoxycarbonyl-6-methyl-2-oxidanylidene-1-(phenylmethyl)-4H-pyrimidin-3-yl]-1-methoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-3-[1-benzyl-5-ethoxycarbonyl-6-methyl-2-oxo-4-(2-vinylphenyl)-4H-pyrimidin-3-yl]-2-diazonio-1-methoxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-diazonio-3-[4-(2-ethenylphenyl)-5-ethoxycarbonyl-6-methyl-2-oxo-1-(phenylmethyl)-4H-pyrimidin-3-yl]-1-methoxy-3-oxo-1-propen-1-olate IUPAC Name: (Z)-3-[1-benzyl-4-(2-ethenylphenyl)-5-ethoxycarbonyl-6-methyl-2-oxo-4H-pyrimidin-3-yl]-2-diazonio-1-methoxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-3-[1-benzyl-5-carbethoxy-2-keto-6-methyl-4-(2-vinylphenyl)-4H-pyrimidin-3-yl]-2-diazonio-3-keto-1-methoxy-prop-1-en-1-olate Formula: C27H26N4O6 MolecularWeight: 502.51854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC=CC=C2C=C)C(=O)C(=C([O-])OC)[N+]#N)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC=CC=C2C=C)C(=O)/C(=C(\[O-])/OC)/[N+]#N)CC3=CC=CC=C3)C

InChI

InChI=1S/C27H26N4O6/c1-5-19-14-10-11-15-20(19)23-21(25(33)37-6-2)17(3)30(16-18-12-8-7-9-13-18)27(35)31(23)24(32)22(29-28)26(34)36-4/h5,7-15,23H,1,6,16H2,2-4H3