N,N-dibutyl-4-methylsulfonyl-2,6-dinitro-aniline

Systemtic Name: N,N-dibutyl-4-methylsulfonyl-2,6-dinitro-aniline Openeye Name: N,N-dibutyl-4-methylsulfonyl-2,6-dinitro-aniline CAS Name: N,N-dibutyl-4-methylsulfonyl-2,6-dinitroaniline IUPAC Name: N,N-dibutyl-4-methylsulfonyl-2,6-dinitroaniline Traditional Name: dibutyl-(4-mesyl-2,6-dinitro-phenyl)amine Formula: C15H23N3O6S MolecularWeight: 373.42462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O6S/c1-4-6-8-16(9-7-5-2)15-13(17(19)20)10-12(25(3,23)24)11-14(15)18(21)22/h10-11H,4-9H2,1-3H3