(3R)-3-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-phenethyl-piperazin-4-ium-2-one

Systemtic Name: (3R)-3-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-phenethyl-piperazin-4-ium-2-one Openeye Name: (3R)-3-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-ethyl]-4-phenethyl-piperazin-4-ium-2-one CAS Name: (3R)-3-[2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl]-4-phenethyl-2-piperazin-4-iumone IUPAC Name: (3R)-3-[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl]-4-phenethylpiperazin-4-ium-2-one Traditional Name: (3R)-3-[2-[4-(2-furoyl)piperazino]-2-keto-ethyl]-4-phenethyl-piperazin-4-ium-2-one Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)N2CCN(CC2)C(=O)C3=CC=CO3)CCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)N2CCN(CC2)C(=O)C3=CC=CO3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O4/c28-21(26-12-14-27(15-13-26)23(30)20-7-4-16-31-20)17-19-22(29)24-9-11-25(19)10-8-18-5-2-1-3-6-18/h1-7,16,19H,8-15,17H2,(H,24,29)/p+1/t19-/m1/s1