1-(3-nitrophenyl)ethyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoate

Systemtic Name: 1-(3-nitrophenyl)ethyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]ethanoate Openeye Name: 1-(3-nitrophenyl)ethyl 2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetate CAS Name: 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl 2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetate Traditional Name: 2-[4-[methyl(2-thienylsulfonyl)amino]phenoxy]acetic acid 1-(3-nitrophenyl)ethyl ester Formula: C21H20N2O7S2 MolecularWeight: 476.5227

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H20N2O7S2/c1-15(16-5-3-6-18(13-16)23(25)26)30-20(24)14-29-19-10-8-17(9-11-19)22(2)32(27,28)21-7-4-12-31-21/h3-13,15H,14H2,1-2H3