2-[(5-aminocarbonyl-2,4-dinitro-phenyl)amino]ethyl ethanoate

Systemtic Name: 2-[(5-aminocarbonyl-2,4-dinitro-phenyl)amino]ethyl ethanoate Openeye Name: 2-(5-carbamoyl-2,4-dinitro-anilino)ethyl acetate CAS Name: acetic acid 2-(5-carbamoyl-2,4-dinitroanilino)ethyl ester IUPAC Name: 2-(5-carbamoyl-2,4-dinitroanilino)ethyl acetate Traditional Name: acetic acid 2-(5-carbamoyl-2,4-dinitro-anilino)ethyl ester Formula: C11H12N4O7 MolecularWeight: 312.23558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCNC1=C(C=C(C(=C1)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCNC1=C(C=C(C(=C1)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O7/c1-6(16)22-3-2-13-8-4-7(11(12)17)9(14(18)19)5-10(8)15(20)21/h4-5,13H,2-3H2,1H3,(H2,12,17)