[4-(2-phenoxyethyl)-1-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]piperidin-4-yl]methanol

Systemtic Name: [4-(2-phenoxyethyl)-1-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]piperidin-4-yl]methanol Openeye Name: [1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-(2-phenoxyethyl)-4-piperidyl]methanol CAS Name: [4-(2-phenoxyethyl)-1-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4-piperidinyl]methanol IUPAC Name: [1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-(2-phenoxyethyl)piperidin-4-yl]methanol Traditional Name: [1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-(2-phenoxyethyl)-4-piperidyl]methanol Formula: C25H35N2O2+ MolecularWeight: 395.5576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1N2CCC(CC2)(CCOC3=CC=CC=C3)CO)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@H]1N2CCC(CC2)(CCOC3=CC=CC=C3)CO)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N2O2/c28-21-25(14-18-29-24-9-5-2-6-10-24)12-16-27(17-13-25)23-11-15-26(20-23)19-22-7-3-1-4-8-22/h1-10,23,28H,11-21H2/p+1/t23-/m0/s1