7-[(2-cyano-4-nitro-phenyl)amino]heptanoate

Systemtic Name: 7-[(2-cyano-4-nitro-phenyl)amino]heptanoate Openeye Name: 7-(2-cyano-4-nitro-anilino)heptanoate CAS Name: 7-(2-cyano-4-nitroanilino)heptanoate IUPAC Name: 7-(2-cyano-4-nitroanilino)heptanoate Traditional Name: 7-(2-cyano-4-nitro-anilino)enanthate Formula: C14H16N3O4- MolecularWeight: 290.29454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4/c15-10-11-9-12(17(20)21)6-7-13(11)16-8-4-2-1-3-5-14(18)19/h6-7,9,16H,1-5,8H2,(H,18,19)/p-1