3-[(4-cyano-2-nitro-phenyl)amino]propyl ethanoate

Systemtic Name: 3-[(4-cyano-2-nitro-phenyl)amino]propyl ethanoate Openeye Name: 3-(4-cyano-2-nitro-anilino)propyl acetate CAS Name: acetic acid 3-(4-cyano-2-nitroanilino)propyl ester IUPAC Name: 3-(4-cyano-2-nitroanilino)propyl acetate Traditional Name: acetic acid 3-(4-cyano-2-nitro-anilino)propyl ester Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCNC1=C(C=C(C=C1)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCCNC1=C(C=C(C=C1)C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4/c1-9(16)19-6-2-5-14-11-4-3-10(8-13)7-12(11)15(17)18/h3-4,7,14H,2,5-6H2,1H3