pentyl 4-[(4-iodanyl-3-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: pentyl 4-[(4-iodanyl-3-nitro-phenyl)carbonylamino]benzoate Openeye Name: pentyl 4-[(4-iodo-3-nitro-benzoyl)amino]benzoate CAS Name: 4-[[(4-iodo-3-nitrophenyl)-oxomethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(4-iodo-3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(4-iodo-3-nitro-benzoyl)amino]benzoic acid amyl ester Formula: C19H19IN2O5 MolecularWeight: 482.26903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19IN2O5/c1-2-3-4-11-27-19(24)13-5-8-15(9-6-13)21-18(23)14-7-10-16(20)17(12-14)22(25)26/h5-10,12H,2-4,11H2,1H3,(H,21,23)