4-[(2,4-dichlorophenyl)amino]-7-[(E)-2-pyridin-4-ylethenyl]quinoline-3-carboxylic acid

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-7-[(E)-2-pyridin-4-ylethenyl]quinoline-3-carboxylic acid Openeye Name: 4-(2,4-dichloroanilino)-7-[(E)-2-(4-pyridyl)vinyl]quinoline-3-carboxylic acid CAS Name: 4-(2,4-dichloroanilino)-7-[(E)-2-pyridin-4-ylethenyl]-3-quinolinecarboxylic acid IUPAC Name: 4-(2,4-dichloroanilino)-7-[(E)-2-pyridin-4-ylethenyl]quinoline-3-carboxylic acid Traditional Name: 4-(2,4-dichloroanilino)-7-[(E)-2-(4-pyridyl)vinyl]quinoline-3-carboxylic acid Formula: C23H15Cl2N3O2 MolecularWeight: 436.2901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN=C2C=C1C=CC3=CC=NC=C3)C(=O)O)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC2=C(C(=CN=C2C=C1/C=C/C3=CC=NC=C3)C(=O)O)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H15Cl2N3O2/c24-16-4-6-20(19(25)12-16)28-22-17-5-3-15(2-1-14-7-9-26-10-8-14)11-21(17)27-13-18(22)23(29)30/h1-13H,(H,27,28)(H,29,30)/b2-1+