methyl 3-(2-morpholin-4-ylsulfonyl-4-nitro-phenoxy)benzoate

Systemtic Name: methyl 3-(2-morpholin-4-ylsulfonyl-4-nitro-phenoxy)benzoate Openeye Name: methyl 3-(2-morpholinosulfonyl-4-nitro-phenoxy)benzoate CAS Name: 3-[2-(4-morpholinylsulfonyl)-4-nitrophenoxy]benzoic acid methyl ester IUPAC Name: methyl 3-(2-morpholin-4-ylsulfonyl-4-nitrophenoxy)benzoate Traditional Name: 3-(2-morpholinosulfonyl-4-nitro-phenoxy)benzoic acid methyl ester Formula: C18H18N2O8S MolecularWeight: 422.40912

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H18N2O8S/c1-26-18(21)13-3-2-4-15(11-13)28-16-6-5-14(20(22)23)12-17(16)29(24,25)19-7-9-27-10-8-19/h2-6,11-12H,7-10H2,1H3