(2S)-2-[[1-(furan-2-ylcarbonylamino)cyclohexyl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[1-(furan-2-ylcarbonylamino)cyclohexyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[1-(furan-2-carbonylamino)cyclohexanecarbonyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[[1-[[2-furanyl(oxo)methyl]amino]cyclohexyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[1-(furan-2-carbonylamino)cyclohexanecarbonyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[1-(2-furoylamino)cyclohexanecarbonyl]amino]-3-phenyl-propionic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NC(CC2=CC=CC=C2)C(=O)O)NC(=O)C3=CC=CO3

Isomeric SMILES

C1CCC(CC1)(C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H24N2O5/c24-18(17-10-7-13-28-17)23-21(11-5-2-6-12-21)20(27)22-16(19(25)26)14-15-8-3-1-4-9-15/h1,3-4,7-10,13,16H,2,5-6,11-12,14H2,(H,22,27)(H,23,24)(H,25,26)/t16-/m0/s1