ethyl 4-methyl-3-[(3-nitrophenyl)methylsulfonylamino]benzoate

Systemtic Name: ethyl 4-methyl-3-[(3-nitrophenyl)methylsulfonylamino]benzoate Openeye Name: ethyl 4-methyl-3-[(3-nitrophenyl)methylsulfonylamino]benzoate CAS Name: 4-methyl-3-[(3-nitrophenyl)methylsulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-[(3-nitrophenyl)methylsulfonylamino]benzoate Traditional Name: 4-methyl-3-[(3-nitrobenzyl)sulfonylamino]benzoic acid ethyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O6S/c1-3-25-17(20)14-8-7-12(2)16(10-14)18-26(23,24)11-13-5-4-6-15(9-13)19(21)22/h4-10,18H,3,11H2,1-2H3