6-[[3-propan-2-yloxy-5-(2-thiophen-3-ylethoxy)phenyl]carbonylamino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[3-propan-2-yloxy-5-(2-thiophen-3-ylethoxy)phenyl]carbonylamino]pyridine-3-carboxylic acid Openeye Name: 6-[[3-isopropoxy-5-[2-(3-thienyl)ethoxy]benzoyl]amino]pyridine-3-carboxylic acid CAS Name: 6-[[oxo-[3-propan-2-yloxy-5-[2-(3-thiophenyl)ethoxy]phenyl]methyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[3-propan-2-yloxy-5-(2-thiophen-3-ylethoxy)benzoyl]amino]pyridine-3-carboxylic acid Traditional Name: 6-[[3-isopropoxy-5-[2-(3-thienyl)ethoxy]benzoyl]amino]nicotinic acid Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=CC(=C1)OCCC2=CSC=C2)C(=O)NC3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)OC1=CC(=CC(=C1)OCCC2=CSC=C2)C(=O)NC3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H22N2O5S/c1-14(2)29-19-10-17(9-18(11-19)28-7-5-15-6-8-30-13-15)21(25)24-20-4-3-16(12-23-20)22(26)27/h3-4,6,8-14H,5,7H2,1-2H3,(H,26,27)(H,23,24,25)