5-[butanoyl(hexadecyl)amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[butanoyl(hexadecyl)amino]thiophene-2-carboxylic acid Openeye Name: 5-[butanoyl(hexadecyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[hexadecyl(1-oxobutyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[butanoyl(hexadecyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[butyryl(cetyl)amino]-2-thenoic acid Formula: C25H43NO3S MolecularWeight: 437.67882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(C1=CC=C(S1)C(=O)O)C(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCN(C1=CC=C(S1)C(=O)O)C(=O)CCC

InChI

InChI=1S/C25H43NO3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(23(27)18-4-2)24-20-19-22(30-24)25(28)29/h19-20H,3-18,21H2,1-2H3,(H,28,29)