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

Systemtic Name: methyl 4-[[2-nitro-4-(phenylcarbonyl)phenyl]amino]butanoate Openeye Name: methyl 4-(4-benzoyl-2-nitro-anilino)butanoate CAS Name: 4-(4-benzoyl-2-nitroanilino)butanoic acid methyl ester IUPAC Name: methyl 4-(4-benzoyl-2-nitroanilino)butanoate Traditional Name: 4-(4-benzoyl-2-nitro-anilino)butyric acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-25-17(21)8-5-11-19-15-10-9-14(12-16(15)20(23)24)18(22)13-6-3-2-4-7-13/h2-4,6-7,9-10,12,19H,5,8,11H2,1H3