tert-butyl N-[3-[3,5-bis(chloranyl)-2-nitro-4-sulfamoyl-phenyl]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[3,5-bis(chloranyl)-2-nitro-4-sulfamoyl-phenyl]propyl]carbamate Openeye Name: tert-butyl N-[3-(3,5-dichloro-2-nitro-4-sulfamoyl-phenyl)propyl]carbamate CAS Name: N-[3-(3,5-dichloro-2-nitro-4-sulfamoylphenyl)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(3,5-dichloro-2-nitro-4-sulfamoylphenyl)propyl]carbamate Traditional Name: N-[3-(3,5-dichloro-2-nitro-4-sulfamoyl-phenyl)propyl]carbamic acid tert-butyl ester Formula: C14H19Cl2N3O6S MolecularWeight: 428.28816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC1=CC(=C(C(=C1[N+](=O)[O-])Cl)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC1=CC(=C(C(=C1[N+](=O)[O-])Cl)S(=O)(=O)N)Cl

InChI

InChI=1S/C14H19Cl2N3O6S/c1-14(2,3)25-13(20)18-6-4-5-8-7-9(15)12(26(17,23)24)10(16)11(8)19(21)22/h7H,4-6H2,1-3H3,(H,18,20)(H2,17,23,24)