(4-methyl-1,4-diazepan-4-ium-1-yl)-(2-methylfuran-3-yl)methanone

Systemtic Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-methylfuran-3-yl)methanone Openeye Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-methyl-3-furyl)methanone CAS Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-methyl-3-furanyl)methanone IUPAC Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-methylfuran-3-yl)methanone Traditional Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-methyl-3-furyl)methanone Formula: C12H19N2O2+ MolecularWeight: 223.29146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N2CCC[NH+](CC2)C

Isomeric SMILES

CC1=C(C=CO1)C(=O)N2CCC[NH+](CC2)C

InChI

InChI=1S/C12H18N2O2/c1-10-11(4-9-16-10)12(15)14-6-3-5-13(2)7-8-14/h4,9H,3,5-8H2,1-2H3/p+1