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

Systemtic Name: methyl 6-[[2-nitro-4-(phenylcarbonyl)phenyl]amino]hexanoate Openeye Name: methyl 6-(4-benzoyl-2-nitro-anilino)hexanoate CAS Name: 6-(4-benzoyl-2-nitroanilino)hexanoic acid methyl ester IUPAC Name: methyl 6-(4-benzoyl-2-nitroanilino)hexanoate Traditional Name: 6-(4-benzoyl-2-nitro-anilino)hexanoic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCCCNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O5/c1-27-19(23)10-6-3-7-13-21-17-12-11-16(14-18(17)22(25)26)20(24)15-8-4-2-5-9-15/h2,4-5,8-9,11-12,14,21H,3,6-7,10,13H2,1H3