3-(furan-2-ylmethylamino)-4-[methyl(phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-(furan-2-ylmethylamino)-4-[methyl(phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-(2-furylmethylamino)-4-(N-methylanilino)-4-oxo-butanoic acid CAS Name: 3-(2-furanylmethylamino)-4-(N-methylanilino)-4-oxobutanoic acid IUPAC Name: 3-(furan-2-ylmethylamino)-4-(N-methylanilino)-4-oxobutanoic acid Traditional Name: 3-(2-furfurylamino)-4-keto-4-(N-methylanilino)butyric acid Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-18(12-6-3-2-4-7-12)16(21)14(10-15(19)20)17-11-13-8-5-9-22-13/h2-9,14,17H,10-11H2,1H3,(H,19,20)