3-(3-azanyl-6-methoxy-2,4-dinitro-phenyl)propane-1,2-diol

Systemtic Name: 3-(3-azanyl-6-methoxy-2,4-dinitro-phenyl)propane-1,2-diol Openeye Name: 3-(3-amino-6-methoxy-2,4-dinitro-phenyl)propane-1,2-diol CAS Name: 3-(3-amino-6-methoxy-2,4-dinitrophenyl)propane-1,2-diol IUPAC Name: 3-(3-amino-6-methoxy-2,4-dinitrophenyl)propane-1,2-diol Traditional Name: 3-(3-amino-6-methoxy-2,4-dinitro-phenyl)propane-1,2-diol Formula: C10H13N3O7 MolecularWeight: 287.22612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-])CC(CO)O

Isomeric SMILES

COC1=C(C(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-])CC(CO)O

InChI

InChI=1S/C10H13N3O7/c1-20-8-3-7(12(16)17)9(11)10(13(18)19)6(8)2-5(15)4-14/h3,5,14-15H,2,4,11H2,1H3