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1-(6-chloranylphenanthren-3-yl)-2-(diheptylamino)ethanol hydrochloride
1-(6-chloranylphenanthren-3-yl)-2-(diheptylamino)ethanol hydrochloride
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCN(CCCCCCC)CC(C1=CC2=C(C=CC3=C2C=C(C=C3)Cl)C=C1)O.Cl
Isomeric SMILES
CCCCCCCN(CCCCCCC)CC(C1=CC2=C(C=CC3=C2C=C(C=C3)Cl)C=C1)O.Cl
InChI
InChI=1S/C30H42ClNO.ClH/c1-3-5-7-9-11-19-32(20-12-10-8-6-4-2)23-30(33)26-16-15-24-13-14-25-17-18-27(31)22-29(25)28(24)21-26;/h13-18,21-22,30,33H,3-12,19-20,23H2,1-2H3;1H
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