N-[4-[butanoyl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]phenyl]-N-(4-methyl-3-nitro-phenyl)sulfonyl-butanamide

Systemtic Name: N-[4-[butanoyl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]phenyl]-N-(4-methyl-3-nitro-phenyl)sulfonyl-butanamide Openeye Name: N-[4-[butanoyl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]phenyl]-N-(4-methyl-3-nitro-phenyl)sulfonyl-butanamide CAS Name: N-(4-methyl-3-nitrophenyl)sulfonyl-N-[4-[(4-methyl-3-nitrophenyl)sulfonyl-(1-oxobutyl)amino]phenyl]butanamide IUPAC Name: N-[4-[butanoyl-(4-methyl-3-nitrophenyl)sulfonylamino]phenyl]-N-(4-methyl-3-nitrophenyl)sulfonylbutanamide Traditional Name: N-[4-[butyryl-(4-methyl-3-nitro-phenyl)sulfonyl-amino]phenyl]-N-(4-methyl-3-nitro-phenyl)sulfonyl-butyramide Formula: C28H30N4O10S2 MolecularWeight: 646.6886

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC=C(C=C1)N(C(=O)CCC)S(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])S(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)N(C1=CC=C(C=C1)N(C(=O)CCC)S(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])S(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C28H30N4O10S2/c1-5-7-27(33)29(43(39,40)23-15-9-19(3)25(17-23)31(35)36)21-11-13-22(14-12-21)30(28(34)8-6-2)44(41,42)24-16-10-20(4)26(18-24)32(37)38/h9-18H,5-8H2,1-4H3