methyl 2-[[4-(4-methylphenyl)sulfonylphenyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethanoate

Systemtic Name: methyl 2-[[4-(4-methylphenyl)sulfonylphenyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethanoate Openeye Name: methyl 2-[N-tert-butoxycarbonyl-4-(p-tolylsulfonyl)anilino]acetate CAS Name: 2-[4-(4-methylphenyl)sulfonyl-N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-methylphenyl)sulfonyl-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]acetate Traditional Name: 2-(N-tert-butoxycarbonyl-4-tosyl-anilino)acetic acid methyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N(CC(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N(CC(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H25NO6S/c1-15-6-10-17(11-7-15)29(25,26)18-12-8-16(9-13-18)22(14-19(23)27-5)20(24)28-21(2,3)4/h6-13H,14H2,1-5H3