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

Systemtic Name: 4-tert-butyl-N-(1,3-dioxolan-2-ylmethyl)-2,6-dinitro-aniline Openeye Name: 4-tert-butyl-N-(1,3-dioxolan-2-ylmethyl)-2,6-dinitro-aniline CAS Name: 4-tert-butyl-N-(1,3-dioxolan-2-ylmethyl)-2,6-dinitroaniline IUPAC Name: 4-tert-butyl-N-(1,3-dioxolan-2-ylmethyl)-2,6-dinitroaniline Traditional Name: (4-tert-butyl-2,6-dinitro-phenyl)-(1,3-dioxolan-2-ylmethyl)amine Formula: C14H19N3O6 MolecularWeight: 325.31716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)[N+](=O)[O-])NCC2OCCO2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)[N+](=O)[O-])NCC2OCCO2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O6/c1-14(2,3)9-6-10(16(18)19)13(11(7-9)17(20)21)15-8-12-22-4-5-23-12/h6-7,12,15H,4-5,8H2,1-3H3