2-[hexadecyl-(4-methoxyphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[hexadecyl-(4-methoxyphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[hexadecyl-(4-methoxyphenyl)sulfonyl-amino]acetic acid CAS Name: 2-[hexadecyl-(4-methoxyphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[hexadecyl-(4-methoxyphenyl)sulfonylamino]acetic acid Traditional Name: 2-[cetyl-(4-methoxyphenyl)sulfonyl-amino]acetic acid Formula: C25H43NO5S MolecularWeight: 469.67762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C25H43NO5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26(22-25(27)28)32(29,30)24-19-17-23(31-2)18-20-24/h17-20H,3-16,21-22H2,1-2H3,(H,27,28)