pentyl 4-[(4-nitrophenyl)sulfonylamino]benzoate

Systemtic Name: pentyl 4-[(4-nitrophenyl)sulfonylamino]benzoate Openeye Name: pentyl 4-[(4-nitrophenyl)sulfonylamino]benzoate CAS Name: 4-[(4-nitrophenyl)sulfonylamino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(4-nitrophenyl)sulfonylamino]benzoate Traditional Name: 4-(nosylamino)benzoic acid amyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O6S/c1-2-3-4-13-26-18(21)14-5-7-15(8-6-14)19-27(24,25)17-11-9-16(10-12-17)20(22)23/h5-12,19H,2-4,13H2,1H3