(3S)-1-(2,2-diphenylethyl)-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium

Systemtic Name: (3S)-1-(2,2-diphenylethyl)-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium Openeye Name: (3S)-1-(2,2-diphenylethyl)-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium CAS Name: (3S)-1-(2,2-diphenylethyl)-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium IUPAC Name: (3S)-1-(2,2-diphenylethyl)-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium Traditional Name: (3S)-1-(2,2-diphenylethyl)-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium Formula: C24H30N3+ MolecularWeight: 360.5151

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NN=C1)C2CCC[NH+](C2)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(NN=C1)[C@H]2CCC[NH+](C2)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N3/c1-2-19-16-25-26-24(19)22-14-9-15-27(17-22)18-23(20-10-5-3-6-11-20)21-12-7-4-8-13-21/h3-8,10-13,16,22-23H,2,9,14-15,17-18H2,1H3,(H,25,26)/p+1/t22-/m0/s1