(3-nitrophenyl)methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoate

Systemtic Name: (3-nitrophenyl)methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoate Openeye Name: (3-nitrophenyl)methyl 2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetate Traditional Name: 2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetic acid (3-nitrobenzyl) ester Formula: C20H18N2O7S2 MolecularWeight: 462.49612

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)OCC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)OCC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H18N2O7S2/c1-21(31(26,27)20-6-3-11-30-20)16-7-9-18(10-8-16)28-14-19(23)29-13-15-4-2-5-17(12-15)22(24)25/h2-12H,13-14H2,1H3