N-[(2R)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2R)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1R)-2-(4-benzhydrylpiperazin-4-ium-1-yl)-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2R)-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2R)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1R)-2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-1-methyl-ethyl]-2-furamide Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C[C@H](C(=O)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C25H27N3O3/c1-19(26-24(29)22-13-8-18-31-22)25(30)28-16-14-27(15-17-28)23(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-13,18-19,23H,14-17H2,1H3,(H,26,29)/p+1/t19-/m1/s1