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4-nitrooxybutyl 2-[3-(phenylcarbonyl)phenyl]propanoate

4-nitrooxybutyl 2-[3-(phenylcarbonyl)phenyl]propanoate

Systemtic Name:4-nitrooxybutyl 2-[3-(phenylcarbonyl)phenyl]propanoate
Openeye Name:4-nitrooxybutyl 2-(3-benzoylphenyl)propanoate
CAS Name:2-(3-benzoylphenyl)propanoic acid 4-nitrooxybutyl ester
IUPAC Name:4-nitrooxybutyl 2-(3-benzoylphenyl)propanoate
Traditional Name:2-(3-benzoylphenyl)propionic acid 4-nitrooxybutyl ester
Formula: C20H21NO6
MolecularWeight: 371.38384
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OCCCCO[N+](=O)[O-]


Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OCCCCO[N+](=O)[O-]


InChI

InChI=1S/C20H21NO6/c1-15(20(23)26-12-5-6-13-27-21(24)25)17-10-7-11-18(14-17)19(22)16-8-3-2-4-9-16/h2-4,7-11,14-15H,5-6,12-13H2,1H3


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