[4-[(2R)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-[(2R)-3-naphthalen-2-yloxy-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-[(2R)-2-hydroxy-3-(2-naphthyloxy)propyl]piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-[(2R)-2-hydroxy-3-(2-naphthalenyloxy)propyl]-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-[(2R)-2-hydroxy-3-naphthalen-2-yloxypropyl]piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-[(2R)-2-hydroxy-3-(2-naphthoxy)propyl]piperazin-4-ium-1-yl]-phenyl-methanone Formula: C24H27N2O3+ MolecularWeight: 391.48278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC3=CC=CC=C3C=C2)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=CC3=CC=CC=C3C=C2)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3/c27-22(18-29-23-11-10-19-6-4-5-9-21(19)16-23)17-25-12-14-26(15-13-25)24(28)20-7-2-1-3-8-20/h1-11,16,22,27H,12-15,17-18H2/p+1/t22-/m1/s1