N-(1,3-dioxolan-2-ylmethyl)-N,4-dimethyl-2,6-dinitro-aniline

Systemtic Name: N-(1,3-dioxolan-2-ylmethyl)-N,4-dimethyl-2,6-dinitro-aniline Openeye Name: N-(1,3-dioxolan-2-ylmethyl)-N,4-dimethyl-2,6-dinitro-aniline CAS Name: N-(1,3-dioxolan-2-ylmethyl)-N,4-dimethyl-2,6-dinitroaniline IUPAC Name: N-(1,3-dioxolan-2-ylmethyl)-N,4-dimethyl-2,6-dinitroaniline Traditional Name: 1,3-dioxolan-2-ylmethyl-methyl-(4-methyl-2,6-dinitro-phenyl)amine Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])N(C)CC2OCCO2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])N(C)CC2OCCO2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O6/c1-8-5-9(14(16)17)12(10(6-8)15(18)19)13(2)7-11-20-3-4-21-11/h5-6,11H,3-4,7H2,1-2H3