(E)-3-(3-but-3-ynoxy-4-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-but-3-ynoxy-4-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-but-3-ynoxy-4-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-but-3-ynoxy-4-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-but-3-ynoxy-4-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-but-3-ynoxy-4-methoxy-phenyl)acrylic acid Formula: C14H14O4 MolecularWeight: 246.25856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)O)OCCC#C

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)O)OCCC#C

InChI

InChI=1S/C14H14O4/c1-3-4-9-18-13-10-11(6-8-14(15)16)5-7-12(13)17-2/h1,5-8,10H,4,9H2,2H3,(H,15,16)/b8-6+