methyl (E)-3-[3-methoxy-4-oxidanyl-5-(2-phenylethynyl)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-methoxy-4-oxidanyl-5-(2-phenylethynyl)phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-hydroxy-3-methoxy-5-(2-phenylethynyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-hydroxy-3-methoxy-5-(2-phenylethynyl)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-hydroxy-3-methoxy-5-(2-phenylethynyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-hydroxy-3-methoxy-5-(2-phenylethynyl)phenyl]acrylic acid methyl ester Formula: C19H16O4 MolecularWeight: 308.32794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OC)C#CC2=CC=CC=C2)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)OC)C#CC2=CC=CC=C2)O

InChI

InChI=1S/C19H16O4/c1-22-17-13-15(9-11-18(20)23-2)12-16(19(17)21)10-8-14-6-4-3-5-7-14/h3-7,9,11-13,21H,1-2H3/b11-9+