2-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methylamino]benzoic acid

Systemtic Name: 2-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-ylidene]methylamino]benzoic acid Openeye Name: 2-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]benzoic acid CAS Name: 2-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]benzoic acid IUPAC Name: 2-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]benzoic acid Traditional Name: 2-[(4,6-diketo-2,2-dimethyl-1,3-dioxan-5-ylidene)methylamino]benzoic acid Formula: C14H13NO6 MolecularWeight: 291.25612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2=CC=CC=C2C(=O)O)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2=CC=CC=C2C(=O)O)C(=O)O1)C

InChI

InChI=1S/C14H13NO6/c1-14(2)20-12(18)9(13(19)21-14)7-15-10-6-4-3-5-8(10)11(16)17/h3-7,15H,1-2H3,(H,16,17)