ethyl (Z)-3-chloranyl-2-(2-phenylethynyl)but-2-enoate

Systemtic Name: ethyl (Z)-3-chloranyl-2-(2-phenylethynyl)but-2-enoate Openeye Name: ethyl (Z)-3-chloro-2-(2-phenylethynyl)but-2-enoate CAS Name: (Z)-3-chloro-2-(2-phenylethynyl)-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-chloro-2-(2-phenylethynyl)but-2-enoate Traditional Name: (Z)-3-chloro-2-(2-phenylethynyl)but-2-enoic acid ethyl ester Formula: C14H13ClO2 MolecularWeight: 248.70482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)Cl)C#CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C(=C(/C)\Cl)/C#CC1=CC=CC=C1

InChI

InChI=1S/C14H13ClO2/c1-3-17-14(16)13(11(2)15)10-9-12-7-5-4-6-8-12/h4-8H,3H2,1-2H3/b13-11-