2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[3-methoxy-4-(2-pyrrolidinoethoxy)phenyl]thiazol-4-yl]acetic acid Formula: C18H22N2O4S MolecularWeight: 362.44328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NC(=CS2)CC(=O)O)OCCN3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NC(=CS2)CC(=O)O)OCCN3CCCC3

InChI

InChI=1S/C18H22N2O4S/c1-23-16-10-13(18-19-14(12-25-18)11-17(21)22)4-5-15(16)24-9-8-20-6-2-3-7-20/h4-5,10,12H,2-3,6-9,11H2,1H3,(H,21,22)