4-methyl-N-[2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[2-[(4-methyl-3-nitrophenyl)sulfonylamino]ethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[2-[(4-methyl-3-nitrophenyl)sulfonylamino]ethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-[2-[(4-methyl-3-nitro-phenyl)sulfonylamino]ethyl]-3-nitro-benzenesulfonamide Formula: C16H18N4O8S2 MolecularWeight: 458.46612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCNS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCNS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O8S2/c1-11-3-5-13(9-15(11)19(21)22)29(25,26)17-7-8-18-30(27,28)14-6-4-12(2)16(10-14)20(23)24/h3-6,9-10,17-18H,7-8H2,1-2H3