2-[[2-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydropyran-4-yl)amino]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydropyran-4-yl)amino]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydropyran-4-yl)amino]anilino]-2-oxo-acetic acid CAS Name: 2-[2-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydropyran-4-yl)amino]anilino]-2-oxoacetic acid IUPAC Name: 2-[2-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydropyran-4-yl)amino]anilino]-2-oxoacetic acid Traditional Name: 2-[2-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydropyran-4-yl)amino]anilino]-2-keto-acetic acid Formula: C16H17N3O5 MolecularWeight: 331.32328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C=C(O1)C#N)NC2=CC=CC=C2NC(=O)C(=O)O)O)C

Isomeric SMILES

CC1(C(C(C=C(O1)C#N)NC2=CC=CC=C2NC(=O)C(=O)O)O)C

InChI

InChI=1S/C16H17N3O5/c1-16(2)13(20)12(7-9(8-17)24-16)18-10-5-3-4-6-11(10)19-14(21)15(22)23/h3-7,12-13,18,20H,1-2H3,(H,19,21)(H,22,23)