cyclopropyl-[2-[(4-ethanoyl-3-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-fluorophenyl)methyl]azanium

Systemtic Name: cyclopropyl-[2-[(4-ethanoyl-3-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-fluorophenyl)methyl]azanium Openeye Name: [2-[(4-acetyl-3-ethoxycarbonyl-5-methyl-2-furyl)amino]-2-oxo-ethyl]-cyclopropyl-[(4-fluorophenyl)methyl]ammonium CAS Name: [2-[(4-acetyl-3-ethoxycarbonyl-5-methyl-2-furanyl)amino]-2-oxoethyl]-cyclopropyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [2-[(4-acetyl-3-ethoxycarbonyl-5-methylfuran-2-yl)amino]-2-oxoethyl]-cyclopropyl-[(4-fluorophenyl)methyl]azanium Traditional Name: [2-[(4-acetyl-3-carbethoxy-5-methyl-2-furyl)amino]-2-keto-ethyl]-cyclopropyl-(4-fluorobenzyl)ammonium Formula: C22H26FN2O5+ MolecularWeight: 417.450643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)C[NH+](CC2=CC=C(C=C2)F)C3CC3

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)C[NH+](CC2=CC=C(C=C2)F)C3CC3

InChI

InChI=1S/C22H25FN2O5/c1-4-29-22(28)20-19(13(2)26)14(3)30-21(20)24-18(27)12-25(17-9-10-17)11-15-5-7-16(23)8-6-15/h5-8,17H,4,9-12H2,1-3H3,(H,24,27)/p+1