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2-[(E)-1-cyano-2-[4-(3-methylbutoxy)phenyl]ethenyl]quinazolin-4-olate
2-[(E)-1-cyano-2-[4-(3-methylbutoxy)phenyl]ethenyl]quinazolin-4-olate
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)CCOC1=CC=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3C(=N2)[O-]
Isomeric SMILES
CC(C)CCOC1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3C(=N2)[O-]
InChI
InChI=1S/C22H21N3O2/c1-15(2)11-12-27-18-9-7-16(8-10-18)13-17(14-23)21-24-20-6-4-3-5-19(20)22(26)25-21/h3-10,13,15H,11-12H2,1-2H3,(H,24,25,26)/p-1/b17-13+
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