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

Systemtic Name: 4-[(2-ethylphenyl)amino]-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-ethylanilino)-2-(2-furylmethylamino)-4-oxo-butanoic acid CAS Name: 4-(2-ethylanilino)-2-(2-furanylmethylamino)-4-oxobutanoic acid IUPAC Name: 4-(2-ethylanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid Traditional Name: 4-(2-ethylanilino)-2-(2-furfurylamino)-4-keto-butyric acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CC(C(=O)O)NCC2=CC=CO2

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CC(C(=O)O)NCC2=CC=CO2

InChI

InChI=1S/C17H20N2O4/c1-2-12-6-3-4-8-14(12)19-16(20)10-15(17(21)22)18-11-13-7-5-9-23-13/h3-9,15,18H,2,10-11H2,1H3,(H,19,20)(H,21,22)