N-cyclobutyl-N,3,4-trimethyl-2,6-dinitro-aniline

Systemtic Name: N-cyclobutyl-N,3,4-trimethyl-2,6-dinitro-aniline Openeye Name: N-cyclobutyl-N,3,4-trimethyl-2,6-dinitro-aniline CAS Name: N-cyclobutyl-N,3,4-trimethyl-2,6-dinitroaniline IUPAC Name: N-cyclobutyl-N,3,4-trimethyl-2,6-dinitroaniline Traditional Name: cyclobutyl-(3,4-dimethyl-2,6-dinitro-phenyl)-methyl-amine Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)[N+](=O)[O-])N(C)C2CCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1C)[N+](=O)[O-])N(C)C2CCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O4/c1-8-7-11(15(17)18)13(12(9(8)2)16(19)20)14(3)10-5-4-6-10/h7,10H,4-6H2,1-3H3