2-[[3-(ethylsulfonylamino)phenyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethanoic acid

Systemtic Name: 2-[[3-(ethylsulfonylamino)phenyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethanoic acid Openeye Name: 2-[N-tert-butoxycarbonyl-3-(ethylsulfonylamino)anilino]acetic acid CAS Name: 2-[3-(ethylsulfonylamino)-N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino]acetic acid IUPAC Name: 2-[3-(ethylsulfonylamino)-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]acetic acid Traditional Name: 2-[N-tert-butoxycarbonyl-3-(esylamino)anilino]acetic acid Formula: C15H22N2O6S MolecularWeight: 358.40998

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC(=CC=C1)N(CC(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCS(=O)(=O)NC1=CC(=CC=C1)N(CC(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H22N2O6S/c1-5-24(21,22)16-11-7-6-8-12(9-11)17(10-13(18)19)14(20)23-15(2,3)4/h6-9,16H,5,10H2,1-4H3,(H,18,19)