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4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol

4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol

Systemtic Name:4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol
Openeye Name:4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol
CAS Name:4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol
IUPAC Name:4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol
Traditional Name:4-[3-[1-[3-(4-chlorophenyl)-1-adamantyl]ethylamino]butyl]phenol
Formula: C28H36ClNO
MolecularWeight: 438.04454
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)O)NC(C)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)Cl


Isomeric SMILES

CC(CCC1=CC=C(C=C1)O)NC(C)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)Cl


InChI

InChI=1S/C28H36ClNO/c1-19(3-4-21-5-11-26(31)12-6-21)30-20(2)27-14-22-13-23(15-27)17-28(16-22,18-27)24-7-9-25(29)10-8-24/h5-12,19-20,22-23,30-31H,3-4,13-18H2,1-2H3


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