2-(2-methylcyclohexyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-(2-methylcyclohexyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-(2-methylcyclohexyl)-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-(2-methylcyclohexyl)-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-(2-methylcyclohexyl)-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-(2-methylcyclohexyl)isoindoline-5-carboxylic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

Isomeric SMILES

CC1CCCCC1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

InChI

InChI=1S/C16H17NO4/c1-9-4-2-3-5-13(9)17-14(18)11-7-6-10(16(20)21)8-12(11)15(17)19/h6-9,13H,2-5H2,1H3,(H,20,21)