(1S,2R)-2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2R)-2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2R)-2-[[2-(2-furylmethylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2R)-2-[[2-[(2-furanylmethylamino)-oxomethyl]anilino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2R)-2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-[[2-(2-furfurylcarbamoyl)phenyl]carbamoyl]cyclohexanecarboxylate Formula: C20H21N2O5- MolecularWeight: 369.39114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)C(=O)[O-]

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)C(=O)[O-]

InChI

InChI=1S/C20H22N2O5/c23-18(21-12-13-6-5-11-27-13)16-9-3-4-10-17(16)22-19(24)14-7-1-2-8-15(14)20(25)26/h3-6,9-11,14-15H,1-2,7-8,12H2,(H,21,23)(H,22,24)(H,25,26)/p-1/t14-,15+/m1/s1