(1R)-2-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]-1-phenyl-ethanol

Systemtic Name: (1R)-2-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]-1-phenyl-ethanol Openeye Name: (1R)-2-[4-[(5-chloro-2-methoxy-phenyl)methyl]piperazin-4-ium-1-yl]-1-phenyl-ethanol CAS Name: (1R)-2-[4-[(5-chloro-2-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-1-phenylethanol IUPAC Name: (1R)-2-[4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-1-phenylethanol Traditional Name: (1R)-2-[4-(5-chloro-2-methoxy-benzyl)piperazin-4-ium-1-yl]-1-phenyl-ethanol Formula: C20H26ClN2O2+ MolecularWeight: 361.88564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C[NH+]2CCN(CC2)CC(C3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C[NH+]2CCN(CC2)C[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C20H25ClN2O2/c1-25-20-8-7-18(21)13-17(20)14-22-9-11-23(12-10-22)15-19(24)16-5-3-2-4-6-16/h2-8,13,19,24H,9-12,14-15H2,1H3/p+1/t19-/m0/s1