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

Systemtic Name: (2R)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazino)propan-1-one Formula: C22H29N4O3+ MolecularWeight: 397.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H28N4O3/c1-18(23-9-13-26(14-10-23)22(28)20-8-5-17-29-20)21(27)25-15-11-24(12-16-25)19-6-3-2-4-7-19/h2-8,17-18H,9-16H2,1H3/p+1/t18-/m1/s1