dimethyl 4-[3-[2-[(4-nitrophenyl)methylsulfanyl]ethanoylamino]phenoxy]benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4-[3-[2-[(4-nitrophenyl)methylsulfanyl]ethanoylamino]phenoxy]benzene-1,2-dicarboxylate Openeye Name: dimethyl 4-[3-[[2-[(4-nitrophenyl)methylsulfanyl]acetyl]amino]phenoxy]benzene-1,2-dicarboxylate CAS Name: 4-[3-[[2-[(4-nitrophenyl)methylthio]-1-oxoethyl]amino]phenoxy]benzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-[3-[[2-[(4-nitrophenyl)methylsulfanyl]acetyl]amino]phenoxy]benzene-1,2-dicarboxylate Traditional Name: 4-[3-[[2-[(4-nitrobenzyl)thio]acetyl]amino]phenoxy]benzene-1,2-dicarboxylic acid dimethyl ester Formula: C25H22N2O8S MolecularWeight: 510.51578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)OC2=CC=CC(=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)OC2=CC=CC(=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C25H22N2O8S/c1-33-24(29)21-11-10-20(13-22(21)25(30)34-2)35-19-5-3-4-17(12-19)26-23(28)15-36-14-16-6-8-18(9-7-16)27(31)32/h3-13H,14-15H2,1-2H3,(H,26,28)