2-ethyl-2-methyl-butanamide; 4-methylsulfonyl-2,6-dinitro-N,N-dipropyl-aniline

Systemtic Name: 2-ethyl-2-methyl-butanamide; 4-methylsulfonyl-2,6-dinitro-N,N-dipropyl-aniline Openeye Name: 2-ethyl-2-methyl-butanamide; 4-methylsulfonyl-2,6-dinitro-N,N-dipropyl-aniline CAS Name: 2-ethyl-2-methylbutanamide; 4-methylsulfonyl-2,6-dinitro-N,N-dipropylaniline IUPAC Name: 2-ethyl-2-methylbutanamide; 4-methylsulfonyl-2,6-dinitro-N,N-dipropylaniline Traditional Name: 2-ethyl-2-methyl-butyramide; (4-mesyl-2,6-dinitro-phenyl)-dipropyl-amine Formula: C20H34N4O7S MolecularWeight: 474.57156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-].CCC(C)(CC)C(=O)N

Isomeric SMILES

CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-].CCC(C)(CC)C(=O)N

InChI

InChI=1S/C13H19N3O6S.C7H15NO/c1-4-6-14(7-5-2)13-11(15(17)18)8-10(23(3,21)22)9-12(13)16(19)20;1-4-7(3,5-2)6(8)9/h8-9H,4-7H2,1-3H3;4-5H2,1-3H3,(H2,8,9)