(2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazino)propan-1-one Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C23H30N4O2/c1-19(24-11-13-26(14-12-24)21-7-9-22(28)10-8-21)23(29)27-17-15-25(16-18-27)20-5-3-2-4-6-20/h2-10,19,28H,11-18H2,1H3/p+1/t19-/m1/s1