[(3S)-3-[4-(hydroxymethyl)piperidin-1-ium-1-yl]piperidin-1-yl]-(3-phenylphenyl)methanone

Systemtic Name: [(3S)-3-[4-(hydroxymethyl)piperidin-1-ium-1-yl]piperidin-1-yl]-(3-phenylphenyl)methanone Openeye Name: [(3S)-3-[4-(hydroxymethyl)piperidin-1-ium-1-yl]-1-piperidyl]-(3-phenylphenyl)methanone CAS Name: [(3S)-3-[4-(hydroxymethyl)-1-piperidin-1-iumyl]-1-piperidinyl]-(3-phenylphenyl)methanone IUPAC Name: [(3S)-3-[4-(hydroxymethyl)piperidin-1-ium-1-yl]piperidin-1-yl]-(3-phenylphenyl)methanone Traditional Name: [(3S)-3-(4-methylolpiperidin-1-ium-1-yl)piperidino]-(3-phenylphenyl)methanone Formula: C24H31N2O2+ MolecularWeight: 379.51514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC(=C2)C3=CC=CC=C3)[NH+]4CCC(CC4)CO

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC=CC(=C2)C3=CC=CC=C3)[NH+]4CCC(CC4)CO

InChI

InChI=1S/C24H30N2O2/c27-18-19-11-14-25(15-12-19)23-10-5-13-26(17-23)24(28)22-9-4-8-21(16-22)20-6-2-1-3-7-20/h1-4,6-9,16,19,23,27H,5,10-15,17-18H2/p+1/t23-/m0/s1