(2S)-1-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol Openeye Name: (2S)-1-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol CAS Name: (2S)-1-[4-(3,4-dichlorophenyl)-1-piperazin-1-iumyl]-3-phenoxy-2-propanol IUPAC Name: (2S)-1-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-3-phenoxypropan-2-ol Traditional Name: (2S)-1-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-3-phenoxy-propan-2-ol Formula: C19H23Cl2N2O2+ MolecularWeight: 382.30412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC=CC=C2)O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1C[C@@H](COC2=CC=CC=C2)O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H22Cl2N2O2/c20-18-7-6-15(12-19(18)21)23-10-8-22(9-11-23)13-16(24)14-25-17-4-2-1-3-5-17/h1-7,12,16,24H,8-11,13-14H2/p+1/t16-/m0/s1