2-azanyl-2-[(4-methoxyphenyl)sulfonylmethyl]-4-[(2-methylpropan-2-yl)oxycarbonyl-phenyl-amino]-3-oxidanylidene-butanoic acid

Systemtic Name: 2-azanyl-2-[(4-methoxyphenyl)sulfonylmethyl]-4-[(2-methylpropan-2-yl)oxycarbonyl-phenyl-amino]-3-oxidanylidene-butanoic acid Openeye Name: 2-amino-4-(N-tert-butoxycarbonylanilino)-2-[(4-methoxyphenyl)sulfonylmethyl]-3-oxo-butanoic acid CAS Name: 2-amino-2-[(4-methoxyphenyl)sulfonylmethyl]-4-(N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino)-3-oxobutanoic acid IUPAC Name: 2-amino-2-[(4-methoxyphenyl)sulfonylmethyl]-4-[N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-3-oxobutanoic acid Traditional Name: 2-amino-4-(N-tert-butoxycarbonylanilino)-3-keto-2-[(4-methoxyphenyl)sulfonylmethyl]butyric acid Formula: C23H28N2O8S MolecularWeight: 492.54202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)C(CS(=O)(=O)C1=CC=C(C=C1)OC)(C(=O)O)N)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)C(CS(=O)(=O)C1=CC=C(C=C1)OC)(C(=O)O)N)C2=CC=CC=C2

InChI

InChI=1S/C23H28N2O8S/c1-22(2,3)33-21(29)25(16-8-6-5-7-9-16)14-19(26)23(24,20(27)28)15-34(30,31)18-12-10-17(32-4)11-13-18/h5-13H,14-15,24H2,1-4H3,(H,27,28)