2-(3-carboxy-4-piperidin-1-yl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-(3-carboxy-4-piperidin-1-yl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[3-carboxy-4-(1-piperidyl)phenyl]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[3-carboxy-4-(1-piperidinyl)phenyl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-(3-carboxy-4-piperidin-1-ylphenyl)-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 2-(3-carboxy-4-piperidino-phenyl)-1,3-diketo-isoindoline-5-carboxylic acid Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C21H18N2O6/c24-18-14-6-4-12(20(26)27)10-15(14)19(25)23(18)13-5-7-17(16(11-13)21(28)29)22-8-2-1-3-9-22/h4-7,10-11H,1-3,8-9H2,(H,26,27)(H,28,29)