N,N'-bis[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]octanediamide

Systemtic Name: N,N'-bis[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]octanediamide Openeye Name: N,N'-bis[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]octanediamide CAS Name: N,N'-bis[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]octanediamide IUPAC Name: N,N'-bis[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]octanediamide Traditional Name: N,N'-bis[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]suberamide Formula: C26H34N4O10S2 MolecularWeight: 626.69896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NC(=O)CCCCCCC(=O)NC2=CC(=C(C(=C2)C)S(=O)(=O)C[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NC(=O)CCCCCCC(=O)NC2=CC(=C(C(=C2)C)S(=O)(=O)C[N+](=O)[O-])C

InChI

InChI=1S/C26H34N4O10S2/c1-17-11-21(12-18(2)25(17)41(37,38)15-29(33)34)27-23(31)9-7-5-6-8-10-24(32)28-22-13-19(3)26(20(4)14-22)42(39,40)16-30(35)36/h11-14H,5-10,15-16H2,1-4H3,(H,27,31)(H,28,32)