4-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[4-(3,4-dimethoxyphenyl)-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]amino]benzoic acid Formula: C18H16N2O4S MolecularWeight: 356.39564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C18H16N2O4S/c1-23-15-8-5-12(9-16(15)24-2)14-10-25-18(20-14)19-13-6-3-11(4-7-13)17(21)22/h3-10H,1-2H3,(H,19,20)(H,21,22)