methyl 2-[(3,5-dimethylphenyl)-(2-nitrophenyl)sulfonyl-amino]ethanoate

Systemtic Name: methyl 2-[(3,5-dimethylphenyl)-(2-nitrophenyl)sulfonyl-amino]ethanoate Openeye Name: methyl 2-(3,5-dimethyl-N-(2-nitrophenyl)sulfonyl-anilino)acetate CAS Name: 2-(3,5-dimethyl-N-(2-nitrophenyl)sulfonylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(3,5-dimethyl-N-(2-nitrophenyl)sulfonylanilino)acetate Traditional Name: 2-(3,5-dimethyl-N-(2-nitrophenyl)sulfonyl-anilino)acetic acid methyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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