1-[(2R)-butan-2-yl]-2-[(furan-2-ylcarbonylamino)methyl]benzimidazole-5-carboxylate

Systemtic Name: 1-[(2R)-butan-2-yl]-2-[(furan-2-ylcarbonylamino)methyl]benzimidazole-5-carboxylate Openeye Name: 2-[(furan-2-carbonylamino)methyl]-1-[(1R)-1-methylpropyl]benzimidazole-5-carboxylate CAS Name: 1-[(2R)-butan-2-yl]-2-[[[2-furanyl(oxo)methyl]amino]methyl]-5-benzimidazolecarboxylate IUPAC Name: 1-[(2R)-butan-2-yl]-2-[(furan-2-carbonylamino)methyl]benzimidazole-5-carboxylate Traditional Name: 2-[(2-furoylamino)methyl]-1-[(1R)-1-methylpropyl]benzimidazole-5-carboxylate Formula: C18H18N3O4- MolecularWeight: 340.35322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C=C2)C(=O)[O-])N=C1CNC(=O)C3=CC=CO3

Isomeric SMILES

CC[C@@H](C)N1C2=C(C=C(C=C2)C(=O)[O-])N=C1CNC(=O)C3=CC=CO3

InChI

InChI=1S/C18H19N3O4/c1-3-11(2)21-14-7-6-12(18(23)24)9-13(14)20-16(21)10-19-17(22)15-5-4-8-25-15/h4-9,11H,3,10H2,1-2H3,(H,19,22)(H,23,24)/p-1/t11-/m1/s1