[(1S)-1-(5-methylfuran-2-yl)ethyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: [(1S)-1-(5-methylfuran-2-yl)ethyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(1S)-1-(5-methyl-2-furyl)ethyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(1S)-1-(5-methyl-2-furanyl)ethyl]-[2-methyl-2-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(5-methylfuran-2-yl)ethyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(1S)-1-(5-methyl-2-furyl)ethyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C16H31N3O+2 MolecularWeight: 281.43684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H29N3O/c1-13-6-7-15(20-13)14(2)17-12-16(3,4)19-10-8-18(5)9-11-19/h6-7,14,17H,8-12H2,1-5H3/p+2/t14-/m0/s1