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

Systemtic Name: 1-[(S)-(4-ethylphenyl)-piperidin-1-ium-4-yl-methyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[(S)-(4-ethylphenyl)-piperidin-1-ium-4-yl-methyl]-4-methyl-piperazin-4-ium CAS Name: 1-[(S)-(4-ethylphenyl)-(4-piperidin-1-iumyl)methyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[(S)-(4-ethylphenyl)-piperidin-1-ium-4-ylmethyl]-4-methylpiperazin-4-ium Traditional Name: 1-[(S)-(4-ethylphenyl)-piperidin-1-ium-4-yl-methyl]-4-methyl-piperazin-4-ium Formula: C19H33N3+2 MolecularWeight: 303.48542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2CC[NH2+]CC2)N3CC[NH+](CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2CC[NH2+]CC2)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H31N3/c1-3-16-4-6-17(7-5-16)19(18-8-10-20-11-9-18)22-14-12-21(2)13-15-22/h4-7,18-20H,3,8-15H2,1-2H3/p+2/t19-/m1/s1