[3-[4-(furan-2-ylmethoxy)butanoylamino]phenyl]methylazanium

Systemtic Name: [3-[4-(furan-2-ylmethoxy)butanoylamino]phenyl]methylazanium Openeye Name: [3-[4-(2-furylmethoxy)butanoylamino]phenyl]methylammonium CAS Name: [3-[[4-(2-furanylmethoxy)-1-oxobutyl]amino]phenyl]methylammonium IUPAC Name: [3-[4-(furan-2-ylmethoxy)butanoylamino]phenyl]methylazanium Traditional Name: [3-[4-(2-furfuryloxy)butanoylamino]benzyl]ammonium Formula: C16H21N2O3+ MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCOCC2=CC=CO2)C[NH3+]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCOCC2=CC=CO2)C[NH3+]

InChI

InChI=1S/C16H20N2O3/c17-11-13-4-1-5-14(10-13)18-16(19)7-3-8-20-12-15-6-2-9-21-15/h1-2,4-6,9-10H,3,7-8,11-12,17H2,(H,18,19)/p+1