(E)-3-(4-but-3-ynoxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-but-3-ynoxyphenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-but-3-ynoxyphenyl)prop-2-enoic acid CAS Name: (E)-3-(4-but-3-ynoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-but-3-ynoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-but-3-ynoxyphenyl)acrylic acid Formula: C13H12O3 MolecularWeight: 216.23258

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCOC1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

C#CCCOC1=CC=C(C=C1)/C=C/C(=O)O

InChI

InChI=1S/C13H12O3/c1-2-3-10-16-12-7-4-11(5-8-12)6-9-13(14)15/h1,4-9H,3,10H2,(H,14,15)/b9-6+