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

Systemtic Name: 4-[[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]methyl]benzoic acid Openeye Name: 4-[[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]methyl]benzoic acid CAS Name: 4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]benzoic acid IUPAC Name: 4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]benzoic acid Traditional Name: 4-[[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]methyl]benzoic acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNCC2=CC=C(C=C2)C(=O)O)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNCC2=CC=C(C=C2)C(=O)O)C(=O)C1)C

InChI

InChI=1S/C17H19NO4/c1-17(2)7-14(19)13(15(20)8-17)10-18-9-11-3-5-12(6-4-11)16(21)22/h3-6,10,18H,7-9H2,1-2H3,(H,21,22)