tert-butyl 4-[(4-chlorophenyl)-oxidanyl-methyl]thieno[2,3-c]pyridine-2-carboxylate

Systemtic Name: tert-butyl 4-[(4-chlorophenyl)-oxidanyl-methyl]thieno[2,3-c]pyridine-2-carboxylate Openeye Name: tert-butyl 4-[(4-chlorophenyl)-hydroxy-methyl]thieno[2,3-c]pyridine-2-carboxylate CAS Name: 4-[(4-chlorophenyl)-hydroxymethyl]-2-thieno[2,3-c]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-chlorophenyl)-hydroxymethyl]thieno[2,3-c]pyridine-2-carboxylate Traditional Name: 4-[(4-chlorophenyl)-hydroxy-methyl]thieno[2,3-c]pyridine-2-carboxylic acid tert-butyl ester Formula: C19H18ClNO3S MolecularWeight: 375.86912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC2=C(S1)C=NC=C2C(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC2=C(S1)C=NC=C2C(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C19H18ClNO3S/c1-19(2,3)24-18(23)15-8-13-14(9-21-10-16(13)25-15)17(22)11-4-6-12(20)7-5-11/h4-10,17,22H,1-3H3