[1-[(3S)-1-(1-phenethylpiperidin-1-ium-4-yl)piperidin-3-yl]piperidin-1-ium-4-yl]methanol

Systemtic Name: [1-[(3S)-1-(1-phenethylpiperidin-1-ium-4-yl)piperidin-3-yl]piperidin-1-ium-4-yl]methanol Openeye Name: [1-[(3S)-1-(1-phenethylpiperidin-1-ium-4-yl)-3-piperidyl]piperidin-1-ium-4-yl]methanol CAS Name: [1-[(3S)-1-(1-phenethyl-4-piperidin-1-iumyl)-3-piperidinyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [1-[(3S)-1-(1-phenethylpiperidin-1-ium-4-yl)piperidin-3-yl]piperidin-1-ium-4-yl]methanol Traditional Name: [1-[(3S)-1-(1-phenethylpiperidin-1-ium-4-yl)-3-piperidyl]piperidin-1-ium-4-yl]methanol Formula: C24H41N3O+2 MolecularWeight: 387.60184

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CC[NH+](CC2)CCC3=CC=CC=C3)[NH+]4CCC(CC4)CO

Isomeric SMILES

C1C[C@@H](CN(C1)C2CC[NH+](CC2)CCC3=CC=CC=C3)[NH+]4CCC(CC4)CO

InChI

InChI=1S/C24H39N3O/c28-20-22-9-17-26(18-10-22)24-7-4-13-27(19-24)23-11-15-25(16-12-23)14-8-21-5-2-1-3-6-21/h1-3,5-6,22-24,28H,4,7-20H2/p+2/t24-/m0/s1