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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC2=CC=CO2)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC2=CC=CO2)C(=O)CCC(=O)O

InChI

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