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butyl 2,5-bis[(2-nitrophenyl)sulfonyloxy]pentanoate

butyl 2,5-bis[(2-nitrophenyl)sulfonyloxy]pentanoate

Systemtic Name:butyl 2,5-bis[(2-nitrophenyl)sulfonyloxy]pentanoate
Openeye Name:butyl 2,5-bis[(2-nitrophenyl)sulfonyloxy]pentanoate
CAS Name:2,5-bis[(2-nitrophenyl)sulfonyloxy]pentanoic acid butyl ester
IUPAC Name:butyl 2,5-bis[(2-nitrophenyl)sulfonyloxy]pentanoate
Traditional Name:2,5-bis[(2-nitrophenyl)sulfonyloxy]valeric acid butyl ester
Formula: C21H24N2O12S2
MolecularWeight: 560.55146
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CCCOS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]


Isomeric SMILES

CCCCOC(=O)C(CCCOS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]


InChI

InChI=1S/C21H24N2O12S2/c1-2-3-14-33-21(24)18(35-37(31,32)20-13-7-5-10-17(20)23(27)28)11-8-15-34-36(29,30)19-12-6-4-9-16(19)22(25)26/h4-7,9-10,12-13,18H,2-3,8,11,14-15H2,1H3


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