1-(6-bromanylpyridin-2-yl)-4-[2-(4-methyl-3-pentyl-phenyl)ethyl]piperazine hydrochloride

Systemtic Name: 1-(6-bromanylpyridin-2-yl)-4-[2-(4-methyl-3-pentyl-phenyl)ethyl]piperazine hydrochloride Openeye Name: 1-(6-bromo-2-pyridyl)-4-[2-(4-methyl-3-pentyl-phenyl)ethyl]piperazine hydrochloride CAS Name: 1-(6-bromo-2-pyridinyl)-4-[2-(4-methyl-3-pentylphenyl)ethyl]piperazine hydrochloride IUPAC Name: 1-(6-bromopyridin-2-yl)-4-[2-(4-methyl-3-pentylphenyl)ethyl]piperazine hydrochloride Traditional Name: 1-[2-(3-amyl-4-methyl-phenyl)ethyl]-4-(6-bromo-2-pyridyl)piperazine hydrochloride Formula: C23H33BrClN3 MolecularWeight: 466.88522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)CCN2CCN(CC2)C3=NC(=CC=C3)Br)C.Cl

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)CCN2CCN(CC2)C3=NC(=CC=C3)Br)C.Cl

InChI

InChI=1S/C23H32BrN3.ClH/c1-3-4-5-7-21-18-20(11-10-19(21)2)12-13-26-14-16-27(17-15-26)23-9-6-8-22(24)25-23;/h6,8-11,18H,3-5,7,12-17H2,1-2H3;1H