methyl 2-methoxy-5-[(4-nitrophenyl)sulfonyl-pent-4-enyl-amino]furan-3-carboxylate

Systemtic Name: methyl 2-methoxy-5-[(4-nitrophenyl)sulfonyl-pent-4-enyl-amino]furan-3-carboxylate Openeye Name: methyl 2-methoxy-5-[(4-nitrophenyl)sulfonyl-pent-4-enyl-amino]furan-3-carboxylate CAS Name: 2-methoxy-5-[(4-nitrophenyl)sulfonyl-pent-4-enylamino]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[(4-nitrophenyl)sulfonyl-pent-4-enylamino]furan-3-carboxylate Traditional Name: 2-methoxy-5-[nosyl(pent-4-enyl)amino]furan-3-carboxylic acid methyl ester Formula: C18H20N2O8S MolecularWeight: 424.425

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(O1)N(CCCC=C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=C(C=C(O1)N(CCCC=C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H20N2O8S/c1-4-5-6-11-19(16-12-15(17(21)26-2)18(27-3)28-16)29(24,25)14-9-7-13(8-10-14)20(22)23/h4,7-10,12H,1,5-6,11H2,2-3H3