4-oxidanylidene-4-[[3-[(E)-2-quinolin-2-ylethenyl]phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[3-[(E)-2-quinolin-2-ylethenyl]phenyl]amino]butanoic acid Openeye Name: 4-oxo-4-[3-[(E)-2-(2-quinolyl)vinyl]anilino]butanoic acid CAS Name: 4-oxo-4-[3-[(E)-2-(2-quinolinyl)ethenyl]anilino]butanoic acid IUPAC Name: 4-oxo-4-[3-[(E)-2-quinolin-2-ylethenyl]anilino]butanoic acid Traditional Name: 4-keto-4-[3-[(E)-2-(2-quinolyl)vinyl]anilino]butyric acid Formula: C21H18N2O3 MolecularWeight: 346.37922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C=CC3=CC(=CC=C3)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)/C=C/C3=CC(=CC=C3)NC(=O)CCC(=O)O

InChI

InChI=1S/C21H18N2O3/c24-20(12-13-21(25)26)23-18-6-3-4-15(14-18)8-10-17-11-9-16-5-1-2-7-19(16)22-17/h1-11,14H,12-13H2,(H,23,24)(H,25,26)/b10-8+