2-[4-oxidanylidenepentyl-(4-phenylmethoxyphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[4-oxidanylidenepentyl-(4-phenylmethoxyphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[(4-benzyloxyphenyl)sulfonyl-(4-oxopentyl)amino]acetic acid CAS Name: 2-[4-oxopentyl-(4-phenylmethoxyphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[4-oxopentyl-(4-phenylmethoxyphenyl)sulfonylamino]acetic acid Traditional Name: 2-[(4-benzoxyphenyl)sulfonyl-(4-ketopentyl)amino]acetic acid Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCN(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)CCCN(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO6S/c1-16(22)6-5-13-21(14-20(23)24)28(25,26)19-11-9-18(10-12-19)27-15-17-7-3-2-4-8-17/h2-4,7-12H,5-6,13-15H2,1H3,(H,23,24)