2-[[3-(phenoxymethyl)furan-2-yl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[3-(phenoxymethyl)furan-2-yl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[[3-(phenoxymethyl)furan-2-carbonyl]amino]ethyl]ammonium CAS Name: 2-[[oxo-[3-(phenoxymethyl)-2-furanyl]methyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[3-(phenoxymethyl)furan-2-carbonyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[[3-(phenoxymethyl)-2-furoyl]amino]ethyl]ammonium Formula: C20H29N2O3+ MolecularWeight: 345.45586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=C(C=CO1)COC2=CC=CC=C2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=C(C=CO1)COC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C20H28N2O3/c1-15(2)22(16(3)4)12-11-21-20(23)19-17(10-13-24-19)14-25-18-8-6-5-7-9-18/h5-10,13,15-16H,11-12,14H2,1-4H3,(H,21,23)/p+1