AC1O3N7X structure

AC1O3N7X

(E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-[3-methoxy-2-(naphthalen-1-ylmethoxy)phenyl]prop-2-enamide

Also Known As: (E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-[3-methoxy-2-(naphthalen-1-ylmethoxy)phenyl]prop-2-enamide|N-(4-chloro-2-nitro-phenyl)-2-cyano-3-[3-methoxy-2-(naphthalen-1-ylmethoxy)phenyl]prop-2-enamide|N-(4-chloro-2-nitrophenyl)-2-cyano-3-{3-methoxy-2-[(naphthalen-1-yl)methoxy]phenyl}prop-2-enamide

CAS: 522657-53-0
Molecular Formula C28H20ClN3O5
Molecular Weight 513.10913 g/mol
LogP 6.53468
Topological Polar Surface Area 114.49 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 513.10913
Monoisotopic Mass 513.10913
Heavy Atoms 37
Complexity 1570.8846

Chemical Identifiers

CAS Number 522657-53-0
SMILES COC1=CC=CC(=C1OCC2=CC=CC3=CC=CC=C32)/C=C(\C#N)/C(=O)NC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Product Overview

AC1O3N7X (CAS 522657-53-0), with molecular formula C28H20ClN3O5 and molecular weight 513.10913 g/mol. IUPAC: (E)-N-(4-chloro-2-nitrophenyl)-2-cyano-3-[3-methoxy-2-(naphthalen-1-ylmethoxy)phenyl]prop-2-enamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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