2-[1-[4-(5-bromanylpentoxy)-5-methoxy-2-nitro-phenyl]carbonylpyrrolidin-2-yl]oxy-2-ethoxy-2-ethylsulfanyl-ethanal

Systemtic Name: 2-[1-[4-(5-bromanylpentoxy)-5-methoxy-2-nitro-phenyl]carbonylpyrrolidin-2-yl]oxy-2-ethoxy-2-ethylsulfanyl-ethanal Openeye Name: 2-[1-[4-(5-bromopentoxy)-5-methoxy-2-nitro-benzoyl]pyrrolidin-2-yl]oxy-2-ethoxy-2-ethylsulfanyl-acetaldehyde CAS Name: 2-[[1-[[4-(5-bromopentoxy)-5-methoxy-2-nitrophenyl]-oxomethyl]-2-pyrrolidinyl]oxy]-2-ethoxy-2-(ethylthio)acetaldehyde IUPAC Name: 2-[1-[4-(5-bromopentoxy)-5-methoxy-2-nitrobenzoyl]pyrrolidin-2-yl]oxy-2-ethoxy-2-ethylsulfanylacetaldehyde Traditional Name: 2-[1-[4-(5-bromopentoxy)-5-methoxy-2-nitro-benzoyl]pyrrolidin-2-yl]oxy-2-ethoxy-2-(ethylthio)acetaldehyde Formula: C23H33BrN2O8S MolecularWeight: 577.48572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C=O)(OC1CCCN1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OCCCCCBr)OC)SCC

Isomeric SMILES

CCOC(C=O)(OC1CCCN1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OCCCCCBr)OC)SCC

InChI

InChI=1S/C23H33BrN2O8S/c1-4-33-23(16-27,35-5-2)34-21-10-9-12-25(21)22(28)17-14-19(31-3)20(15-18(17)26(29)30)32-13-8-6-7-11-24/h14-16,21H,4-13H2,1-3H3