[1-azanyl-3-(2,4-dinitrophenoxy)propan-2-yl] ethanoate

Systemtic Name: [1-azanyl-3-(2,4-dinitrophenoxy)propan-2-yl] ethanoate Openeye Name: [1-(aminomethyl)-2-(2,4-dinitrophenoxy)ethyl] acetate CAS Name: acetic acid [1-amino-3-(2,4-dinitrophenoxy)propan-2-yl] ester IUPAC Name: [1-amino-3-(2,4-dinitrophenoxy)propan-2-yl] acetate Traditional Name: acetic acid [1-(aminomethyl)-2-(2,4-dinitrophenoxy)ethyl] ester Formula: C11H13N3O7 MolecularWeight: 299.23682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O7/c1-7(15)21-9(5-12)6-20-11-3-2-8(13(16)17)4-10(11)14(18)19/h2-4,9H,5-6,12H2,1H3