tert-butyl N-[4-[methyl-(4-nitrophenyl)sulfonyl-amino]butanoylamino]carbamate

Systemtic Name: tert-butyl N-[4-[methyl-(4-nitrophenyl)sulfonyl-amino]butanoylamino]carbamate Openeye Name: tert-butyl N-[4-[methyl-(4-nitrophenyl)sulfonyl-amino]butanoylamino]carbamate CAS Name: N-[[4-[methyl-(4-nitrophenyl)sulfonylamino]-1-oxobutyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[methyl-(4-nitrophenyl)sulfonylamino]butanoylamino]carbamate Traditional Name: N-[4-[methyl(nosyl)amino]butanoylamino]carbamic acid tert-butyl ester Formula: C16H24N4O7S MolecularWeight: 416.44936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)CCCN(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)CCCN(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H24N4O7S/c1-16(2,3)27-15(22)18-17-14(21)6-5-11-19(4)28(25,26)13-9-7-12(8-10-13)20(23)24/h7-10H,5-6,11H2,1-4H3,(H,17,21)(H,18,22)