2-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-ethyl]sulfanylphenyl]amino]ethanoic acid

Systemtic Name: 2-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-ethyl]sulfanylphenyl]amino]ethanoic acid Openeye Name: 2-[4-[2-(tert-butoxycarbonylamino)-2-oxo-ethyl]sulfanylanilino]acetic acid CAS Name: 2-[4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxoethyl]thio]anilino]acetic acid IUPAC Name: 2-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoethyl]sulfanylanilino]acetic acid Traditional Name: 2-[4-[[2-(tert-butoxycarbonylamino)-2-keto-ethyl]thio]anilino]acetic acid Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=O)CSC1=CC=C(C=C1)NCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(=O)CSC1=CC=C(C=C1)NCC(=O)O

InChI

InChI=1S/C15H20N2O5S/c1-15(2,3)22-14(21)17-12(18)9-23-11-6-4-10(5-7-11)16-8-13(19)20/h4-7,16H,8-9H2,1-3H3,(H,19,20)(H,17,18,21)