methyl 2-methoxy-5-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]benzoate CAS Name: 2-methoxy-5-[[(4-methyl-3-nitrophenyl)sulfonylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[(4-methyl-3-nitrophenyl)sulfonylamino]methyl]benzoate Traditional Name: 2-methoxy-5-[[(4-methyl-3-nitro-phenyl)sulfonylamino]methyl]benzoic acid methyl ester Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O7S/c1-11-4-6-13(9-15(11)19(21)22)27(23,24)18-10-12-5-7-16(25-2)14(8-12)17(20)26-3/h4-9,18H,10H2,1-3H3