(3S)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-3-methyl-piperidine

Systemtic Name: (3S)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-3-methyl-piperidine Openeye Name: (3S)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-3-methyl-piperidine CAS Name: (3S)-1-[1-[(4-ethylphenyl)methyl]-4-piperidin-1-iumyl]-3-methylpiperidine IUPAC Name: (3S)-1-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-3-methylpiperidine Traditional Name: (3S)-1-[1-(4-ethylbenzyl)piperidin-1-ium-4-yl]-3-methyl-piperidine Formula: C20H33N2+ MolecularWeight: 301.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)N3CCCC(C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)N3CCC[C@@H](C3)C

InChI

InChI=1S/C20H32N2/c1-3-18-6-8-19(9-7-18)16-21-13-10-20(11-14-21)22-12-4-5-17(2)15-22/h6-9,17,20H,3-5,10-16H2,1-2H3/p+1/t17-/m0/s1