methyl 2-[(2-nitrophenyl)sulfonyl-prop-2-enyl-amino]ethanoate

Systemtic Name: methyl 2-[(2-nitrophenyl)sulfonyl-prop-2-enyl-amino]ethanoate Openeye Name: methyl 2-[allyl-(2-nitrophenyl)sulfonyl-amino]acetate CAS Name: 2-[(2-nitrophenyl)sulfonyl-prop-2-enylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-nitrophenyl)sulfonyl-prop-2-enylamino]acetate Traditional Name: 2-[allyl-(2-nitrophenyl)sulfonyl-amino]acetic acid methyl ester Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O6S/c1-3-8-13(9-12(15)20-2)21(18,19)11-7-5-4-6-10(11)14(16)17/h3-7H,1,8-9H2,2H3