tert-butyl (2R)-3-methyl-2-[(7-nitrodibenzothiophen-2-yl)sulfonylamino]butanoate

Systemtic Name: tert-butyl (2R)-3-methyl-2-[(7-nitrodibenzothiophen-2-yl)sulfonylamino]butanoate Openeye Name: tert-butyl (2R)-3-methyl-2-[(7-nitrodibenzothiophen-2-yl)sulfonylamino]butanoate CAS Name: (2R)-3-methyl-2-[(7-nitro-2-dibenzothiophenyl)sulfonylamino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-3-methyl-2-[(7-nitrodibenzothiophen-2-yl)sulfonylamino]butanoate Traditional Name: (2R)-3-methyl-2-[(7-nitrodibenzothiophen-2-yl)sulfonylamino]butyric acid tert-butyl ester Formula: C21H24N2O6S2 MolecularWeight: 464.55506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=C(C=C1)SC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@H](C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=C(C=C1)SC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O6S2/c1-12(2)19(20(24)29-21(3,4)5)22-31(27,28)14-7-9-17-16(11-14)15-8-6-13(23(25)26)10-18(15)30-17/h6-12,19,22H,1-5H3/t19-/m1/s1