[5-(4-azaniumylpiperidin-1-yl)carbonyl-2-methyl-furan-3-yl]methyl-bis(prop-2-enyl)azanium

Systemtic Name: [5-(4-azaniumylpiperidin-1-yl)carbonyl-2-methyl-furan-3-yl]methyl-bis(prop-2-enyl)azanium Openeye Name: diallyl-[[5-(4-azaniumylpiperidine-1-carbonyl)-2-methyl-3-furyl]methyl]ammonium CAS Name: [5-[(4-ammonio-1-piperidinyl)-oxomethyl]-2-methyl-3-furanyl]methyl-bis(prop-2-enyl)ammonium IUPAC Name: [5-(4-azaniumylpiperidine-1-carbonyl)-2-methylfuran-3-yl]methyl-bis(prop-2-enyl)azanium Traditional Name: diallyl-[[5-(4-ammoniopiperidine-1-carbonyl)-2-methyl-3-furyl]methyl]ammonium Formula: C18H29N3O2+2 MolecularWeight: 319.44176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)N2CCC(CC2)[NH3+])C[NH+](CC=C)CC=C

Isomeric SMILES

CC1=C(C=C(O1)C(=O)N2CCC(CC2)[NH3+])C[NH+](CC=C)CC=C

InChI

InChI=1S/C18H27N3O2/c1-4-8-20(9-5-2)13-15-12-17(23-14(15)3)18(22)21-10-6-16(19)7-11-21/h4-5,12,16H,1-2,6-11,13,19H2,3H3/p+2