3-[2-(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-1-cyano-ethenyl]benzenecarbonitrile

Systemtic Name: 3-[2-(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-1-cyano-ethenyl]benzenecarbonitrile Openeye Name: 3-[2-(3-chloro-5-ethoxy-4-prop-2-ynoxy-phenyl)-1-cyano-vinyl]benzonitrile CAS Name: 3-[2-(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)-1-cyanoethenyl]benzonitrile IUPAC Name: 3-[2-(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)-1-cyanoethenyl]benzonitrile Traditional Name: 3-[2-(3-chloro-5-ethoxy-4-propargyloxy-phenyl)-1-cyano-vinyl]benzonitrile Formula: C21H15ClN2O2 MolecularWeight: 362.809

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=CC(=C2)C#N)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=CC(=C2)C#N)Cl)OCC#C

InChI

InChI=1S/C21H15ClN2O2/c1-3-8-26-21-19(22)11-16(12-20(21)25-4-2)10-18(14-24)17-7-5-6-15(9-17)13-23/h1,5-7,9-12H,4,8H2,2H3