3-(2-oxidanyl-2-oxidanylidene-1-piperidin-1-yl-ethyl)-1-(phenylmethyl)indole-5-carboxylic acid

Systemtic Name: 3-(2-oxidanyl-2-oxidanylidene-1-piperidin-1-yl-ethyl)-1-(phenylmethyl)indole-5-carboxylic acid Openeye Name: 1-benzyl-3-[2-hydroxy-2-oxo-1-(1-piperidyl)ethyl]indole-5-carboxylic acid CAS Name: 3-[2-hydroxy-2-oxo-1-(1-piperidinyl)ethyl]-1-(phenylmethyl)-5-indolecarboxylic acid IUPAC Name: 1-benzyl-3-(2-hydroxy-2-oxo-1-piperidin-1-ylethyl)indole-5-carboxylic acid Traditional Name: 1-benzyl-3-(2-hydroxy-2-keto-1-piperidino-ethyl)indole-5-carboxylic acid Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(C2=CN(C3=C2C=C(C=C3)C(=O)O)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(C2=CN(C3=C2C=C(C=C3)C(=O)O)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H24N2O4/c26-22(27)17-9-10-20-18(13-17)19(15-25(20)14-16-7-3-1-4-8-16)21(23(28)29)24-11-5-2-6-12-24/h1,3-4,7-10,13,15,21H,2,5-6,11-12,14H2,(H,26,27)(H,28,29)