[(2S)-4-chloranyl-3-[(3,4-dimethylphenyl)amino]-5-oxidanylidene-2H-furan-2-yl] furan-2-carboxylate

Systemtic Name: [(2S)-4-chloranyl-3-[(3,4-dimethylphenyl)amino]-5-oxidanylidene-2H-furan-2-yl] furan-2-carboxylate Openeye Name: [(2S)-4-chloro-3-(3,4-dimethylanilino)-5-oxo-2H-furan-2-yl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [(2S)-4-chloro-3-(3,4-dimethylanilino)-5-oxo-2H-furan-2-yl] ester IUPAC Name: [(2S)-4-chloro-3-(3,4-dimethylanilino)-5-oxo-2H-furan-2-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [(2S)-4-chloro-3-(3,4-dimethylanilino)-5-keto-2H-furan-2-yl] ester Formula: C17H14ClNO5 MolecularWeight: 347.74976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C(=O)OC2OC(=O)C3=CC=CO3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C(=O)O[C@@H]2OC(=O)C3=CC=CO3)Cl)C

InChI

InChI=1S/C17H14ClNO5/c1-9-5-6-11(8-10(9)2)19-14-13(18)16(21)24-17(14)23-15(20)12-4-3-7-22-12/h3-8,17,19H,1-2H3/t17-/m0/s1