Chlordimorine
CAS No.:494-14-4
Synonyms: chlordimorinum;
Properties Computed from Structure:
Molecular Weight 331.83648 [g/mol]
Molecular Formula C19H22ClNO2
XLogP 4.3
H-Bond Donor 0
H-Bond Acceptor 3
Rotatable Bond Count 6
Exact Mass 331.133907
MonoIsotopic Mass 331.133907
Topological Polar Surface Area 21.7
Heavy Atom Count 23
Formal Charge 0
Complexity 329
Isotope Atom Count 0
Defined Atom StereoCenter Count 0
Undefined Atom StereoCenter Count 0
Defined Bond StereoCenter Count 0
Undefined Bond StereoCenter Count 0
Covalently-Bonded Unit Count 1
Descriptors Computed from Structure:
IUPAC Name: 4-[3-(2-chloro-4-phenylphenoxy)propyl]morpholine
Canonical SMILES: C1COCCN1CCCOC2=C(C=C(C=C2)C3=CC=CC=C3)Cl
InChI: InChI=1/C19H22ClNO2/c20-18-15-17(16-5-2-1-3-6-16)7-8-19(18)23-12-4-9-21-
10-13-22-14-11-21/h1-3,5-8,15H,4,9-14H2
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