bis[(4-nitrophenyl)methyl] 5-ethoxycarbonylsulfanylpiperidine-1,2-dicarboxylate

Systemtic Name: bis[(4-nitrophenyl)methyl] 5-ethoxycarbonylsulfanylpiperidine-1,2-dicarboxylate Openeye Name: bis[(4-nitrophenyl)methyl] 5-ethoxycarbonylsulfanylpiperidine-1,2-dicarboxylate CAS Name: 5-(ethoxycarbonylthio)piperidine-1,2-dicarboxylic acid bis[(4-nitrophenyl)methyl] ester IUPAC Name: bis[(4-nitrophenyl)methyl] 5-ethoxycarbonylsulfanylpiperidine-1,2-dicarboxylate Traditional Name: 5-(carbethoxythio)piperidine-1,2-dicarboxylic acid bis(4-nitrobenzyl) ester Formula: C24H25N3O10S MolecularWeight: 547.5344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)SC1CCC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)SC1CCC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O10S/c1-2-35-24(30)38-20-11-12-21(22(28)36-14-16-3-7-18(8-4-16)26(31)32)25(13-20)23(29)37-15-17-5-9-19(10-6-17)27(33)34/h3-10,20-21H,2,11-15H2,1H3