2-methylidene-4-oxidanylidene-4-phenyl-3-(pyridin-4-ylmethyl)butanoic acid

Systemtic Name: 2-methylidene-4-oxidanylidene-4-phenyl-3-(pyridin-4-ylmethyl)butanoic acid Openeye Name: 2-methylene-4-oxo-4-phenyl-3-(4-pyridylmethyl)butanoic acid CAS Name: 2-methylene-4-oxo-4-phenyl-3-(pyridin-4-ylmethyl)butanoic acid IUPAC Name: 2-methylidene-4-oxo-4-phenyl-3-(pyridin-4-ylmethyl)butanoic acid Traditional Name: 2-[2-keto-2-phenyl-1-(4-pyridylmethyl)ethyl]acrylic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(CC1=CC=NC=C1)C(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C=C(C(CC1=CC=NC=C1)C(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H15NO3/c1-12(17(20)21)15(11-13-7-9-18-10-8-13)16(19)14-5-3-2-4-6-14/h2-10,15H,1,11H2,(H,20,21)