[(2S)-1-[[(2R)-1-(phenylmethyl)piperidin-1-ium-2-yl]methyl]pyrrolidin-2-yl]methanol

Systemtic Name: [(2S)-1-[[(2R)-1-(phenylmethyl)piperidin-1-ium-2-yl]methyl]pyrrolidin-2-yl]methanol Openeye Name: [(2S)-1-[[(2R)-1-benzylpiperidin-1-ium-2-yl]methyl]pyrrolidin-2-yl]methanol CAS Name: [(2S)-1-[[(2R)-1-(phenylmethyl)-2-piperidin-1-iumyl]methyl]-2-pyrrolidinyl]methanol IUPAC Name: [(2S)-1-[[(2R)-1-benzylpiperidin-1-ium-2-yl]methyl]pyrrolidin-2-yl]methanol Traditional Name: [(2S)-1-[[(2R)-1-benzylpiperidin-1-ium-2-yl]methyl]pyrrolidin-2-yl]methanol Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CN2CCCC2CO)CC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+]([C@H](C1)CN2CCC[C@H]2CO)CC3=CC=CC=C3

InChI

InChI=1S/C18H28N2O/c21-15-18-10-6-12-20(18)14-17-9-4-5-11-19(17)13-16-7-2-1-3-8-16/h1-3,7-8,17-18,21H,4-6,9-15H2/p+1/t17-,18+/m1/s1