(2R)-2-(furan-2-ylmethylamino)-4-oxidanylidene-4-[(4-phenoxyphenyl)amino]butanoic acid

Systemtic Name: (2R)-2-(furan-2-ylmethylamino)-4-oxidanylidene-4-[(4-phenoxyphenyl)amino]butanoic acid Openeye Name: (2R)-2-(2-furylmethylamino)-4-oxo-4-(4-phenoxyanilino)butanoic acid CAS Name: (2R)-2-(2-furanylmethylamino)-4-oxo-4-(4-phenoxyanilino)butanoic acid IUPAC Name: (2R)-2-(furan-2-ylmethylamino)-4-oxo-4-(4-phenoxyanilino)butanoic acid Traditional Name: (2R)-2-(2-furfurylamino)-4-keto-4-(4-phenoxyanilino)butyric acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CC(C(=O)O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C[C@H](C(=O)O)NCC3=CC=CO3

InChI

InChI=1S/C21H20N2O5/c24-20(13-19(21(25)26)22-14-18-7-4-12-27-18)23-15-8-10-17(11-9-15)28-16-5-2-1-3-6-16/h1-12,19,22H,13-14H2,(H,23,24)(H,25,26)/t19-/m1/s1