1-(3-chlorophenyl)-4-[(3S)-1-(3-methylbutyl)piperidin-1-ium-3-yl]piperazine

Systemtic Name: 1-(3-chlorophenyl)-4-[(3S)-1-(3-methylbutyl)piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(3-chlorophenyl)-4-[(3S)-1-isopentylpiperidin-1-ium-3-yl]piperazine CAS Name: 1-(3-chlorophenyl)-4-[(3S)-1-(3-methylbutyl)-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(3-chlorophenyl)-4-[(3S)-1-(3-methylbutyl)piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(3-chlorophenyl)-4-[(3S)-1-isoamylpiperidin-1-ium-3-yl]piperazine Formula: C20H33ClN3+ MolecularWeight: 350.94912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+]1CCCC(C1)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)CC[NH+]1CCC[C@@H](C1)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H32ClN3/c1-17(2)8-10-22-9-4-7-20(16-22)24-13-11-23(12-14-24)19-6-3-5-18(21)15-19/h3,5-6,15,17,20H,4,7-14,16H2,1-2H3/p+1/t20-/m0/s1