hexyl 4-[(4-methyl-3-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: hexyl 4-[(4-methyl-3-nitro-phenyl)carbonylamino]benzoate Openeye Name: hexyl 4-[(4-methyl-3-nitro-benzoyl)amino]benzoate CAS Name: 4-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[(4-methyl-3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(4-methyl-3-nitro-benzoyl)amino]benzoic acid hexyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O5/c1-3-4-5-6-13-28-21(25)16-9-11-18(12-10-16)22-20(24)17-8-7-15(2)19(14-17)23(26)27/h7-12,14H,3-6,13H2,1-2H3,(H,22,24)