2-(furan-2-ylmethylamino)-4-oxidanylidene-4-[(4-propan-2-ylphenyl)amino]butanoic acid

Systemtic Name: 2-(furan-2-ylmethylamino)-4-oxidanylidene-4-[(4-propan-2-ylphenyl)amino]butanoic acid Openeye Name: 2-(2-furylmethylamino)-4-(4-isopropylanilino)-4-oxo-butanoic acid CAS Name: 2-(2-furanylmethylamino)-4-oxo-4-(4-propan-2-ylanilino)butanoic acid IUPAC Name: 2-(furan-2-ylmethylamino)-4-oxo-4-(4-propan-2-ylanilino)butanoic acid Traditional Name: 4-cumidino-2-(2-furfurylamino)-4-keto-butyric acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCC2=CC=CO2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCC2=CC=CO2

InChI

InChI=1S/C18H22N2O4/c1-12(2)13-5-7-14(8-6-13)20-17(21)10-16(18(22)23)19-11-15-4-3-9-24-15/h3-9,12,16,19H,10-11H2,1-2H3,(H,20,21)(H,22,23)