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2-[4-[2-(4-hexadecylpiperazin-1-yl)ethyl]phenyl]ethanoic acid

2-[4-[2-(4-hexadecylpiperazin-1-yl)ethyl]phenyl]ethanoic acid

Systemtic Name:2-[4-[2-(4-hexadecylpiperazin-1-yl)ethyl]phenyl]ethanoic acid
Openeye Name:2-[4-[2-(4-hexadecylpiperazin-1-yl)ethyl]phenyl]acetic acid
CAS Name:2-[4-[2-(4-hexadecyl-1-piperazinyl)ethyl]phenyl]acetic acid
IUPAC Name:2-[4-[2-(4-hexadecylpiperazin-1-yl)ethyl]phenyl]acetic acid
Traditional Name:2-[4-[2-(4-cetylpiperazino)ethyl]phenyl]acetic acid
Formula: C30H52N2O2
MolecularWeight: 472.74608
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1CCN(CC1)CCC2=CC=C(C=C2)CC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCN1CCN(CC1)CCC2=CC=C(C=C2)CC(=O)O


InChI

InChI=1S/C30H52N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21-31-23-25-32(26-24-31)22-20-28-16-18-29(19-17-28)27-30(33)34/h16-19H,2-15,20-27H2,1H3,(H,33,34)


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