[(2R)-2-[[5-[(4-ethoxyphenoxy)methyl]-3-methyl-furan-2-yl]carbonylamino]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium

Systemtic Name: [(2R)-2-[[5-[(4-ethoxyphenoxy)methyl]-3-methyl-furan-2-yl]carbonylamino]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium Openeye Name: [(2R)-2-[[5-[(4-ethoxyphenoxy)methyl]-3-methyl-furan-2-carbonyl]amino]-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [(2R)-2-[[[5-[(4-ethoxyphenoxy)methyl]-3-methyl-2-furanyl]-oxomethyl]amino]-4-hydroxy-4-oxobutyl]-trimethylammonium IUPAC Name: [(2R)-2-[[5-[(4-ethoxyphenoxy)methyl]-3-methylfuran-2-carbonyl]amino]-4-hydroxy-4-oxobutyl]-trimethylazanium Traditional Name: [(2R)-2-[[5-[(4-ethoxyphenoxy)methyl]-3-methyl-2-furoyl]amino]-4-hydroxy-4-keto-butyl]-trimethyl-ammonium Formula: C22H31N2O6+ MolecularWeight: 419.49134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC2=CC(=C(O2)C(=O)NC(CC(=O)O)C[N+](C)(C)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC2=CC(=C(O2)C(=O)N[C@H](CC(=O)O)C[N+](C)(C)C)C

InChI

InChI=1S/C22H30N2O6/c1-6-28-17-7-9-18(10-8-17)29-14-19-11-15(2)21(30-19)22(27)23-16(12-20(25)26)13-24(3,4)5/h7-11,16H,6,12-14H2,1-5H3,(H-,23,25,26,27)/p+1/t16-/m1/s1