methyl 2-[(3-chloranyl-4-methyl-phenyl)-(2-nitrophenyl)sulfonyl-amino]ethanoate

Systemtic Name: methyl 2-[(3-chloranyl-4-methyl-phenyl)-(2-nitrophenyl)sulfonyl-amino]ethanoate Openeye Name: methyl 2-(3-chloro-4-methyl-N-(2-nitrophenyl)sulfonyl-anilino)acetate CAS Name: 2-(3-chloro-4-methyl-N-(2-nitrophenyl)sulfonylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(3-chloro-4-methyl-N-(2-nitrophenyl)sulfonylanilino)acetate Traditional Name: 2-(3-chloro-4-methyl-N-(2-nitrophenyl)sulfonyl-anilino)acetic acid methyl ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN2O6S/c1-11-7-8-12(9-13(11)17)18(10-16(20)25-2)26(23,24)15-6-4-3-5-14(15)19(21)22/h3-9H,10H2,1-2H3