2-[2-[4-(5-phenylpentoxy)phenyl]ethylcarbamoyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-[4-(5-phenylpentoxy)phenyl]ethylcarbamoyl]pyridine-3-carboxylic acid Openeye Name: 2-[2-[4-(5-phenylpentoxy)phenyl]ethylcarbamoyl]pyridine-3-carboxylic acid CAS Name: 2-[oxo-[2-[4-(5-phenylpentoxy)phenyl]ethylamino]methyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[4-(5-phenylpentoxy)phenyl]ethylcarbamoyl]pyridine-3-carboxylic acid Traditional Name: 2-[2-[4-(5-phenylpentoxy)phenyl]ethylcarbamoyl]nicotinic acid Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCOC2=CC=C(C=C2)CCNC(=O)C3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCOC2=CC=C(C=C2)CCNC(=O)C3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C26H28N2O4/c29-25(24-23(26(30)31)11-7-17-27-24)28-18-16-21-12-14-22(15-13-21)32-19-6-2-5-10-20-8-3-1-4-9-20/h1,3-4,7-9,11-15,17H,2,5-6,10,16,18-19H2,(H,28,29)(H,30,31)