1-[1-(1-anthracen-9-ylcarbonylpiperidin-4-yl)piperidin-3-yl]carbonylpiperidine-2-carboxylic acid

Systemtic Name: 1-[1-(1-anthracen-9-ylcarbonylpiperidin-4-yl)piperidin-3-yl]carbonylpiperidine-2-carboxylic acid Openeye Name: 1-[1-[1-(anthracene-9-carbonyl)-4-piperidyl]piperidine-3-carbonyl]piperidine-2-carboxylic acid CAS Name: 1-[[1-[1-[9-anthracenyl(oxo)methyl]-4-piperidinyl]-3-piperidinyl]-oxomethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-[1-(anthracene-9-carbonyl)piperidin-4-yl]piperidine-3-carbonyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-[1-(anthracene-9-carbonyl)-4-piperidyl]nipecotoyl]pipecolinic acid Formula: C32H37N3O4 MolecularWeight: 527.65388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(=O)C2CCCN(C2)C3CCN(CC3)C(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(=O)C2CCCN(C2)C3CCN(CC3)C(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C32H37N3O4/c36-30(35-17-6-5-13-28(35)32(38)39)24-10-7-16-34(21-24)25-14-18-33(19-15-25)31(37)29-26-11-3-1-8-22(26)20-23-9-2-4-12-27(23)29/h1-4,8-9,11-12,20,24-25,28H,5-7,10,13-19,21H2,(H,38,39)