1-[1,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]piperidine-4-carboxylic acid Openeye Name: 1-(1,4-dihydroxy-9,10-dioxo-2-anthryl)piperidine-4-carboxylic acid CAS Name: 1-(1,4-dihydroxy-9,10-dioxo-2-anthracenyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)piperidine-4-carboxylic acid Traditional Name: 1-(1,4-dihydroxy-9,10-diketo-2-anthryl)isonipecotic acid Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=CC(=C3C(=C2O)C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=CC(=C3C(=C2O)C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C20H17NO6/c22-14-9-13(21-7-5-10(6-8-21)20(26)27)19(25)16-15(14)17(23)11-3-1-2-4-12(11)18(16)24/h1-4,9-10,22,25H,5-8H2,(H,26,27)