1-[2-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]-3-phenyl-propan-1-one

Systemtic Name: 1-[2-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]-3-phenyl-propan-1-one Openeye Name: 1-[2-[(2S)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]-3-phenyl-propan-1-one CAS Name: 1-[2-[(2S)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]-3-phenyl-1-propanone IUPAC Name: 1-[2-[(2S)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]-3-phenylpropan-1-one Traditional Name: 1-[2-[(2S)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]-3-phenyl-propan-1-one Formula: C23H30NO3+ MolecularWeight: 368.4892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(COC2=CC=CC=C2C(=O)CCC3=CC=CC=C3)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](COC2=CC=CC=C2C(=O)CCC3=CC=CC=C3)O

InChI

InChI=1S/C23H29NO3/c25-20(17-24-15-7-2-8-16-24)18-27-23-12-6-5-11-21(23)22(26)14-13-19-9-3-1-4-10-19/h1,3-6,9-12,20,25H,2,7-8,13-18H2/p+1/t20-/m0/s1