4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-2-(oxolan-2-ylmethylamino)butanoic acid

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-4-oxidanylidene-2-(oxolan-2-ylmethylamino)butanoic acid Openeye Name: 4-(2,4-dichloroanilino)-4-oxo-2-(tetrahydrofuran-2-ylmethylamino)butanoic acid CAS Name: 4-(2,4-dichloroanilino)-4-oxo-2-(2-oxolanylmethylamino)butanoic acid IUPAC Name: 4-(2,4-dichloroanilino)-4-oxo-2-(oxolan-2-ylmethylamino)butanoic acid Traditional Name: 4-(2,4-dichloroanilino)-4-keto-2-(tetrahydrofurfurylamino)butyric acid Formula: C15H18Cl2N2O4 MolecularWeight: 361.22042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(CC(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(OC1)CNC(CC(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C15H18Cl2N2O4/c16-9-3-4-12(11(17)6-9)19-14(20)7-13(15(21)22)18-8-10-2-1-5-23-10/h3-4,6,10,13,18H,1-2,5,7-8H2,(H,19,20)(H,21,22)