tert-butyl 1,2-bis(azanyl)-2-(2-nitrophenyl)sulfonyl-cyclohexane-1-carboxylate

Systemtic Name: tert-butyl 1,2-bis(azanyl)-2-(2-nitrophenyl)sulfonyl-cyclohexane-1-carboxylate Openeye Name: tert-butyl 1,2-diamino-2-(2-nitrophenyl)sulfonyl-cyclohexanecarboxylate CAS Name: 1,2-diamino-2-(2-nitrophenyl)sulfonyl-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1,2-diamino-2-(2-nitrophenyl)sulfonylcyclohexane-1-carboxylate Traditional Name: 1,2-diamino-2-(2-nitrophenyl)sulfonyl-cyclohexanecarboxylic acid tert-butyl ester Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCCCC1(N)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCCCC1(N)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])N

InChI

InChI=1S/C17H25N3O6S/c1-15(2,3)26-14(21)16(18)10-6-7-11-17(16,19)27(24,25)13-9-5-4-8-12(13)20(22)23/h4-5,8-9H,6-7,10-11,18-19H2,1-3H3