(E)-4-[4-(1,2-dihydropyridin-5-yl)phenyl]but-3-enoic acid

Systemtic Name: (E)-4-[4-(1,2-dihydropyridin-5-yl)phenyl]but-3-enoic acid Openeye Name: (E)-4-[4-(1,2-dihydropyridin-5-yl)phenyl]but-3-enoic acid CAS Name: (E)-4-[4-(1,2-dihydropyridin-5-yl)phenyl]-3-butenoic acid IUPAC Name: (E)-4-[4-(1,2-dihydropyridin-5-yl)phenyl]but-3-enoic acid Traditional Name: (E)-4-[4-(1,2-dihydropyridin-5-yl)phenyl]but-3-enoic acid Formula: C15H15NO2 MolecularWeight: 241.2851

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=CN1)C2=CC=C(C=C2)C=CCC(=O)O

Isomeric SMILES

C1C=CC(=CN1)C2=CC=C(C=C2)/C=C/CC(=O)O

InChI

InChI=1S/C15H15NO2/c17-15(18)5-1-3-12-6-8-13(9-7-12)14-4-2-10-16-11-14/h1-4,6-9,11,16H,5,10H2,(H,17,18)/b3-1+