4-[(2,4-dimethylphenyl)-(furan-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2,4-dimethylphenyl)-(furan-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[N-(2-furylmethyl)-2,4-dimethyl-anilino]-4-oxo-butanoic acid CAS Name: 4-[N-(2-furanylmethyl)-2,4-dimethylanilino]-4-oxobutanoic acid IUPAC Name: 4-[N-(furan-2-ylmethyl)-2,4-dimethylanilino]-4-oxobutanoic acid Traditional Name: 4-[N-(2-furfuryl)-2,4-dimethyl-anilino]-4-keto-butyric acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CC2=CC=CO2)C(=O)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(CC2=CC=CO2)C(=O)CCC(=O)O)C

InChI

InChI=1S/C17H19NO4/c1-12-5-6-15(13(2)10-12)18(11-14-4-3-9-22-14)16(19)7-8-17(20)21/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,21)