[4-[2-(4-ethoxyphenyl)ethynyl]phenyl]methyl oxirane-2-carboxylate

Systemtic Name: [4-[2-(4-ethoxyphenyl)ethynyl]phenyl]methyl oxirane-2-carboxylate Openeye Name: [4-[2-(4-ethoxyphenyl)ethynyl]phenyl]methyl oxirane-2-carboxylate CAS Name: 2-oxiranecarboxylic acid [4-[2-(4-ethoxyphenyl)ethynyl]phenyl]methyl ester IUPAC Name: [4-[2-(4-ethoxyphenyl)ethynyl]phenyl]methyl oxirane-2-carboxylate Traditional Name: oxirane-2-carboxylic acid [4-(2-p-phenetylethynyl)benzyl] ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)COC(=O)C3CO3

Isomeric SMILES

CCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)COC(=O)C3CO3

InChI

InChI=1S/C20H18O4/c1-2-22-18-11-9-16(10-12-18)4-3-15-5-7-17(8-6-15)13-24-20(21)19-14-23-19/h5-12,19H,2,13-14H2,1H3