(4-methylphenyl)methyl 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: (4-methylphenyl)methyl 2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: p-tolylmethyl 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-chloro-3-nitrophenyl)sulfonylamino]acetic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 2-[(4-chloro-3-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-chloro-3-nitro-phenyl)sulfonylamino]acetic acid (4-methylbenzyl) ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN2O6S/c1-11-2-4-12(5-3-11)10-25-16(20)9-18-26(23,24)13-6-7-14(17)15(8-13)19(21)22/h2-8,18H,9-10H2,1H3