methyl 2-[(2-methoxy-2-oxidanylidene-ethyl)-[(2-nitrophenyl)methylsulfonyl]amino]ethanoate

Systemtic Name: methyl 2-[(2-methoxy-2-oxidanylidene-ethyl)-[(2-nitrophenyl)methylsulfonyl]amino]ethanoate Openeye Name: methyl 2-[(2-methoxy-2-oxo-ethyl)-[(2-nitrophenyl)methylsulfonyl]amino]acetate CAS Name: 2-[(2-methoxy-2-oxoethyl)-[(2-nitrophenyl)methylsulfonyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-methoxy-2-oxoethyl)-[(2-nitrophenyl)methylsulfonyl]amino]acetate Traditional Name: 2-[(2-keto-2-methoxy-ethyl)-(2-nitrobenzyl)sulfonyl-amino]acetic acid methyl ester Formula: C13H16N2O8S MolecularWeight: 360.33974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CC(=O)OC)S(=O)(=O)CC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

COC(=O)CN(CC(=O)OC)S(=O)(=O)CC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O8S/c1-22-12(16)7-14(8-13(17)23-2)24(20,21)9-10-5-3-4-6-11(10)15(18)19/h3-6H,7-9H2,1-2H3