methyl 3-methyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]methylsulfonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]methylsulfonylamino]butanoate Openeye Name: methyl 2-[[4-(tert-butoxycarbonylamino)phenyl]methylsulfonylamino]-3-methyl-butanoate CAS Name: 3-methyl-2-[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]methylsulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]methylsulfonylamino]butanoate Traditional Name: 2-[[4-(tert-butoxycarbonylamino)benzyl]sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C18H28N2O6S MolecularWeight: 400.48972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)CC1=CC=C(C=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)(=O)CC1=CC=C(C=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H28N2O6S/c1-12(2)15(16(21)25-6)20-27(23,24)11-13-7-9-14(10-8-13)19-17(22)26-18(3,4)5/h7-10,12,15,20H,11H2,1-6H3,(H,19,22)