methyl 6-[(2-cyano-4-nitro-phenyl)amino]hexanoate

Systemtic Name: methyl 6-[(2-cyano-4-nitro-phenyl)amino]hexanoate Openeye Name: methyl 6-(2-cyano-4-nitro-anilino)hexanoate CAS Name: 6-(2-cyano-4-nitroanilino)hexanoic acid methyl ester IUPAC Name: methyl 6-(2-cyano-4-nitroanilino)hexanoate Traditional Name: 6-(2-cyano-4-nitro-anilino)hexanoic acid methyl ester Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)CCCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H17N3O4/c1-21-14(18)5-3-2-4-8-16-13-7-6-12(17(19)20)9-11(13)10-15/h6-7,9,16H,2-5,8H2,1H3