2-[3-chloranyl-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[3-chloranyl-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[3-chloro-5-methoxy-4-[2-(1-piperidyl)ethoxy]phenyl]thiazole-4-carboxylic acid CAS Name: 2-[3-chloro-5-methoxy-4-[2-(1-piperidinyl)ethoxy]phenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[3-chloro-5-methoxy-4-(2-piperidin-1-ylethoxy)phenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[3-chloro-5-methoxy-4-(2-piperidinoethoxy)phenyl]thiazole-4-carboxylic acid Formula: C18H21ClN2O4S MolecularWeight: 396.88834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=NC(=CS2)C(=O)O)Cl)OCCN3CCCCC3

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=NC(=CS2)C(=O)O)Cl)OCCN3CCCCC3

InChI

InChI=1S/C18H21ClN2O4S/c1-24-15-10-12(17-20-14(11-26-17)18(22)23)9-13(19)16(15)25-8-7-21-5-3-2-4-6-21/h9-11H,2-8H2,1H3,(H,22,23)