ethyl 2-[(2,4-dinitronaphthalen-1-yl)amino]ethanoate

Systemtic Name: ethyl 2-[(2,4-dinitronaphthalen-1-yl)amino]ethanoate Openeye Name: ethyl 2-[(2,4-dinitro-1-naphthyl)amino]acetate CAS Name: 2-[(2,4-dinitro-1-naphthalenyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2,4-dinitronaphthalen-1-yl)amino]acetate Traditional Name: 2-[(2,4-dinitro-1-naphthyl)amino]acetic acid ethyl ester Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CNC1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6/c1-2-23-13(18)8-15-14-10-6-4-3-5-9(10)11(16(19)20)7-12(14)17(21)22/h3-7,15H,2,8H2,1H3