1-(4-methoxyphenyl)-4-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]piperazine

Systemtic Name: 1-(4-methoxyphenyl)-4-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(4-methoxyphenyl)-4-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]piperazine CAS Name: 1-(4-methoxyphenyl)-4-[(3S)-1-(3-methylbut-2-enyl)-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(4-methoxyphenyl)-4-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(4-methoxyphenyl)-4-[(3S)-1-(3-methylbut-2-enyl)piperidin-1-ium-3-yl]piperazine Formula: C21H34N3O+ MolecularWeight: 344.51416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O/c1-18(2)10-12-22-11-4-5-20(17-22)24-15-13-23(14-16-24)19-6-8-21(25-3)9-7-19/h6-10,20H,4-5,11-17H2,1-3H3/p+1/t20-/m0/s1