furan-2-ylmethyl-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethyl]azanium

Systemtic Name: furan-2-ylmethyl-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethyl]azanium Openeye Name: 2-furylmethyl-[2-[4-(3-oxobutyl)phenoxy]ethyl]ammonium CAS Name: 2-furanylmethyl-[2-[4-(3-oxobutyl)phenoxy]ethyl]ammonium IUPAC Name: furan-2-ylmethyl-[2-[4-(3-oxobutyl)phenoxy]ethyl]azanium Traditional Name: 2-furfuryl-[2-[4-(3-ketobutyl)phenoxy]ethyl]ammonium Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCC[NH2+]CC2=CC=CO2

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCC[NH2+]CC2=CC=CO2

InChI

InChI=1S/C17H21NO3/c1-14(19)4-5-15-6-8-16(9-7-15)21-12-10-18-13-17-3-2-11-20-17/h2-3,6-9,11,18H,4-5,10,12-13H2,1H3/p+1