2-[2-[3-chloranyl-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[3-chloranyl-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[3-chloro-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[3-chloro-4-(2-dimethylaminoethyloxy)-5-ethoxyphenyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[3-chloro-4-(2-dimethylaminoethyloxy)-5-ethoxyphenyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[3-chloro-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]thiazol-4-yl]acetic acid Formula: C17H21ClN2O4S MolecularWeight: 384.87764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2=NC(=CS2)CC(=O)O)Cl)OCCN(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2=NC(=CS2)CC(=O)O)Cl)OCCN(C)C

InChI

InChI=1S/C17H21ClN2O4S/c1-4-23-14-8-11(17-19-12(10-25-17)9-15(21)22)7-13(18)16(14)24-6-5-20(2)3/h7-8,10H,4-6,9H2,1-3H3,(H,21,22)