[2-[(3-aminocarbonyl-4-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-[(2-methoxy-5-methyl-phenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(3-aminocarbonyl-4-ethoxycarbonyl-5-methyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-[(2-methoxy-5-methyl-phenyl)methyl]-methyl-azanium Openeye Name: [2-[(3-carbamoyl-4-ethoxycarbonyl-5-methyl-2-furyl)amino]-2-oxo-ethyl]-[(2-methoxy-5-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [2-[(3-carbamoyl-4-ethoxycarbonyl-5-methyl-2-furanyl)amino]-2-oxoethyl]-[(2-methoxy-5-methylphenyl)methyl]-methylammonium IUPAC Name: [2-[(3-carbamoyl-4-ethoxycarbonyl-5-methylfuran-2-yl)amino]-2-oxoethyl]-[(2-methoxy-5-methylphenyl)methyl]-methylazanium Traditional Name: [2-[(3-carbamoyl-4-carbethoxy-5-methyl-2-furyl)amino]-2-keto-ethyl]-(2-methoxy-5-methyl-benzyl)-methyl-ammonium Formula: C21H28N3O6+ MolecularWeight: 418.46352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O6/c1-6-29-21(27)17-13(3)30-20(18(17)19(22)26)23-16(25)11-24(4)10-14-9-12(2)7-8-15(14)28-5/h7-9H,6,10-11H2,1-5H3,(H2,22,26)(H,23,25)/p+1