ethyl 2-[(2-methyl-5-nitro-phenyl)sulfonyl-propan-2-yl-amino]ethanoate

Systemtic Name: ethyl 2-[(2-methyl-5-nitro-phenyl)sulfonyl-propan-2-yl-amino]ethanoate Openeye Name: ethyl 2-[isopropyl-(2-methyl-5-nitro-phenyl)sulfonyl-amino]acetate CAS Name: 2-[(2-methyl-5-nitrophenyl)sulfonyl-propan-2-ylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-methyl-5-nitrophenyl)sulfonyl-propan-2-ylamino]acetate Traditional Name: 2-[isopropyl-(2-methyl-5-nitro-phenyl)sulfonyl-amino]acetic acid ethyl ester Formula: C14H20N2O6S MolecularWeight: 344.3834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(C)C)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CN(C(C)C)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C

InChI

InChI=1S/C14H20N2O6S/c1-5-22-14(17)9-15(10(2)3)23(20,21)13-8-12(16(18)19)7-6-11(13)4/h6-8,10H,5,9H2,1-4H3