tert-butyl-ethyl-[(5-piperazin-4-ium-1-ylcarbonylfuran-2-yl)methyl]azanium

Systemtic Name: tert-butyl-ethyl-[(5-piperazin-4-ium-1-ylcarbonylfuran-2-yl)methyl]azanium Openeye Name: tert-butyl-ethyl-[[5-(piperazin-4-ium-1-carbonyl)-2-furyl]methyl]ammonium CAS Name: tert-butyl-ethyl-[[5-[oxo(1-piperazin-4-iumyl)methyl]-2-furanyl]methyl]ammonium IUPAC Name: tert-butyl-ethyl-[[5-(piperazin-4-ium-1-carbonyl)furan-2-yl]methyl]azanium Traditional Name: tert-butyl-ethyl-[[5-(piperazin-4-ium-1-carbonyl)-2-furyl]methyl]ammonium Formula: C16H29N3O2+2 MolecularWeight: 295.42036

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(O1)C(=O)N2CC[NH2+]CC2)C(C)(C)C

Isomeric SMILES

CC[NH+](CC1=CC=C(O1)C(=O)N2CC[NH2+]CC2)C(C)(C)C

InChI

InChI=1S/C16H27N3O2/c1-5-19(16(2,3)4)12-13-6-7-14(21-13)15(20)18-10-8-17-9-11-18/h6-7,17H,5,8-12H2,1-4H3/p+2