3,4-bis[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]benzoic acid

Systemtic Name: 3,4-bis[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]benzoic acid Openeye Name: 3,4-bis[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]benzoic acid CAS Name: 3,4-bis[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]benzoic acid IUPAC Name: 3,4-bis[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]benzoic acid Traditional Name: 3,4-bis[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]benzoic acid Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC2=C(C=C(C=C2)C(=O)O)NC=C3C(=O)CC(CC3=O)(C)C)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNC2=C(C=C(C=C2)C(=O)O)NC=C3C(=O)CC(CC3=O)(C)C)C(=O)C1)C

InChI

InChI=1S/C25H28N2O6/c1-24(2)8-19(28)15(20(29)9-24)12-26-17-6-5-14(23(32)33)7-18(17)27-13-16-21(30)10-25(3,4)11-22(16)31/h5-7,12-13,26-27H,8-11H2,1-4H3,(H,32,33)