1-[2-oxidanyl-2-oxidanylidene-1-(5-phenylmethoxy-1H-indol-3-yl)ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-oxidanyl-2-oxidanylidene-1-(5-phenylmethoxy-1H-indol-3-yl)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(5-benzyloxy-1H-indol-3-yl)-2-hydroxy-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-hydroxy-2-oxo-1-(5-phenylmethoxy-1H-indol-3-yl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-hydroxy-2-oxo-1-(5-phenylmethoxy-1H-indol-3-yl)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(5-benzoxy-1H-indol-3-yl)-2-hydroxy-2-keto-ethyl]isonipecotic acid Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H24N2O5/c26-22(27)16-8-10-25(11-9-16)21(23(28)29)19-13-24-20-7-6-17(12-18(19)20)30-14-15-4-2-1-3-5-15/h1-7,12-13,16,21,24H,8-11,14H2,(H,26,27)(H,28,29)