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O5-[4-[(E)-2-nitroethenyl]phenyl] O1-phenethyl pentanedioate

O5-[4-[(E)-2-nitroethenyl]phenyl] O1-phenethyl pentanedioate

Systemtic Name:O5-[4-[(E)-2-nitroethenyl]phenyl] O1-phenethyl pentanedioate
Openeye Name:O5-[4-[(E)-2-nitrovinyl]phenyl] O1-phenethyl pentanedioate
CAS Name:pentanedioic acid O5-[4-[(E)-2-nitroethenyl]phenyl] ester O1-phenethyl ester
IUPAC Name:5-O-[4-[(E)-2-nitroethenyl]phenyl] 1-O-phenethyl pentanedioate
Traditional Name:glutaric acid O5-[4-[(E)-2-nitrovinyl]phenyl] ester O1-phenethyl ester
Formula: C21H21NO6
MolecularWeight: 383.39454
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(=O)CCCC(=O)OC2=CC=C(C=C2)C=C[N+](=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)CCOC(=O)CCCC(=O)OC2=CC=C(C=C2)/C=C/[N+](=O)[O-]


InChI

InChI=1S/C21H21NO6/c23-20(27-16-14-17-5-2-1-3-6-17)7-4-8-21(24)28-19-11-9-18(10-12-19)13-15-22(25)26/h1-3,5-6,9-13,15H,4,7-8,14,16H2/b15-13+


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