[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-(2-furanylmethyl)-methylammonium IUPAC Name: [2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C25H31N3O2+2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-26(19-23-13-8-18-30-23)20-24(29)27-14-16-28(17-15-27)25(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-13,18,25H,14-17,19-20H2,1H3/p+2