6-[[3-(2-oxidanyl-2-oxidanylidene-1-piperidin-1-yl-ethyl)-1H-indol-5-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3-(2-oxidanyl-2-oxidanylidene-1-piperidin-1-yl-ethyl)-1H-indol-5-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[3-[2-hydroxy-2-oxo-1-(1-piperidyl)ethyl]-1H-indol-5-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[[3-[2-hydroxy-2-oxo-1-(1-piperidinyl)ethyl]-1H-indol-5-yl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3-(2-hydroxy-2-oxo-1-piperidin-1-ylethyl)-1H-indol-5-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3-(2-hydroxy-2-keto-1-piperidino-ethyl)-1H-indol-5-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(C2=CNC3=C2C=C(C=C3)NC(=O)C4CC=CCC4C(=O)O)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(C2=CNC3=C2C=C(C=C3)NC(=O)C4CC=CCC4C(=O)O)C(=O)O

InChI

InChI=1S/C23H27N3O5/c27-21(15-6-2-3-7-16(15)22(28)29)25-14-8-9-19-17(12-14)18(13-24-19)20(23(30)31)26-10-4-1-5-11-26/h2-3,8-9,12-13,15-16,20,24H,1,4-7,10-11H2,(H,25,27)(H,28,29)(H,30,31)