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

Systemtic Name: (2R)-2-(furan-2-ylmethylamino)-4-[(4-methoxyphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: (2R)-2-(2-furylmethylamino)-4-(4-methoxyanilino)-4-oxo-butanoic acid CAS Name: (2R)-2-(2-furanylmethylamino)-4-(4-methoxyanilino)-4-oxobutanoic acid IUPAC Name: (2R)-2-(furan-2-ylmethylamino)-4-(4-methoxyanilino)-4-oxobutanoic acid Traditional Name: (2R)-2-(2-furfurylamino)-4-keto-4-(p-anisidino)butyric acid Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCC2=CC=CO2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C[C@H](C(=O)O)NCC2=CC=CO2

InChI

InChI=1S/C16H18N2O5/c1-22-12-6-4-11(5-7-12)18-15(19)9-14(16(20)21)17-10-13-3-2-8-23-13/h2-8,14,17H,9-10H2,1H3,(H,18,19)(H,20,21)/t14-/m1/s1