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

Systemtic Name: methyl 3-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-4-methyl-benzoate CAS Name: 3-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-4-methylbenzoate Traditional Name: 3-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]-4-methyl-benzoic acid methyl ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C16H15ClN2O6S/c1-9-4-5-11(16(20)25-3)6-14(9)18-26(23,24)12-7-13(17)10(2)15(8-12)19(21)22/h4-8,18H,1-3H3