(3S)-1-[(4-phenylmethoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium

Systemtic Name: (3S)-1-[(4-phenylmethoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium Openeye Name: (3S)-1-[(4-benzyloxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium CAS Name: (3S)-1-[(4-phenylmethoxyphenyl)methyl]-3-(1-pyrrolidinyl)piperidin-1-ium IUPAC Name: (3S)-1-[(4-phenylmethoxyphenyl)methyl]-3-pyrrolidin-1-ylpiperidin-1-ium Traditional Name: (3S)-1-(4-benzoxybenzyl)-3-pyrrolidino-piperidin-1-ium Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCC[NH+](C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)[C@H]2CCC[NH+](C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H30N2O/c1-2-7-21(8-3-1)19-26-23-12-10-20(11-13-23)17-24-14-6-9-22(18-24)25-15-4-5-16-25/h1-3,7-8,10-13,22H,4-6,9,14-19H2/p+1/t22-/m0/s1