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ethyl 2-azanyl-3-(3,5-dinitro-4-oxidanyl-phenyl)propanoate

ethyl 2-azanyl-3-(3,5-dinitro-4-oxidanyl-phenyl)propanoate

Systemtic Name:ethyl 2-azanyl-3-(3,5-dinitro-4-oxidanyl-phenyl)propanoate
Openeye Name:ethyl 2-amino-3-(4-hydroxy-3,5-dinitro-phenyl)propanoate
CAS Name:2-amino-3-(4-hydroxy-3,5-dinitrophenyl)propanoic acid ethyl ester
IUPAC Name:ethyl 2-amino-3-(4-hydroxy-3,5-dinitrophenyl)propanoate
Traditional Name:2-amino-3-(4-hydroxy-3,5-dinitro-phenyl)propionic acid ethyl ester
Formula: C11H13N3O7
MolecularWeight: 299.23682
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H13N3O7/c1-2-21-11(16)7(12)3-6-4-8(13(17)18)10(15)9(5-6)14(19)20/h4-5,7,15H,2-3,12H2,1H3


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