3-[5-(4-methoxyphenyl)furan-2-yl]-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-[5-(4-methoxyphenyl)furan-2-yl]-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-[5-(4-methoxyphenyl)-2-furyl]-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-[5-(4-methoxyphenyl)-2-furanyl]-1-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-[5-(4-methoxyphenyl)furan-2-yl]-1-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-[5-(4-methoxyphenyl)-2-furyl]-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-1-one Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C(=O)CCC3=CC=C(O3)C4=CC=C(C=C4)OC

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)C(=O)CCC3=CC=C(O3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H28N2O3/c1-26-16-17-27(23(18-26)19-6-4-3-5-7-19)25(28)15-13-22-12-14-24(30-22)20-8-10-21(29-2)11-9-20/h3-12,14,23H,13,15-18H2,1-2H3/p+1/t23-/m0/s1