(E)-3-[4-[4-(furan-2-yl)but-3-ynylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[4-(furan-2-yl)but-3-ynylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[4-(2-furyl)but-3-ynylamino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[4-(2-furanyl)but-3-ynylamino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[4-(furan-2-yl)but-3-ynylamino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[4-(2-furyl)but-3-ynylamino]phenyl]acrylic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C#CCCNC2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

C1=COC(=C1)C#CCCNC2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C17H15NO3/c19-17(20)11-8-14-6-9-15(10-7-14)18-12-2-1-4-16-5-3-13-21-16/h3,5-11,13,18H,2,12H2,(H,19,20)/b11-8+