N,N,3,5-tetramethyl-2,6-dinitro-4-prop-1-en-2-yl-aniline

Systemtic Name: N,N,3,5-tetramethyl-2,6-dinitro-4-prop-1-en-2-yl-aniline Openeye Name: 4-isopropenyl-N,N,3,5-tetramethyl-2,6-dinitro-aniline CAS Name: N,N,3,5-tetramethyl-4-(1-methylethenyl)-2,6-dinitroaniline IUPAC Name: N,N,3,5-tetramethyl-2,6-dinitro-4-prop-1-en-2-ylaniline Traditional Name: (4-isopropenyl-3,5-dimethyl-2,6-dinitro-phenyl)-dimethyl-amine Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1[N+](=O)[O-])N(C)C)[N+](=O)[O-])C)C(=C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1[N+](=O)[O-])N(C)C)[N+](=O)[O-])C)C(=C)C

InChI

InChI=1S/C13H17N3O4/c1-7(2)10-8(3)11(15(17)18)13(14(5)6)12(9(10)4)16(19)20/h1H2,2-6H3