N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-2,2-dimethoxy-ethanamine

Systemtic Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-2,2-dimethoxy-ethanamine Openeye Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-2,2-dimethoxy-ethanamine CAS Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-2,2-dimethoxyethanamine IUPAC Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-2,2-dimethoxyethanamine Traditional Name: 2,2-dimethoxyethyl-(4,5-dimethoxy-2-nitro-benzyl)amine Formula: C13H20N2O6 MolecularWeight: 300.3077

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CNCC(OC)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CNCC(OC)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C13H20N2O6/c1-18-11-5-9(7-14-8-13(20-3)21-4)10(15(16)17)6-12(11)19-2/h5-6,13-14H,7-8H2,1-4H3