4-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]piperidine-1-carboxylic acid

Systemtic Name: 4-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]piperidine-1-carboxylic acid Openeye Name: 4-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]piperidine-1-carboxylic acid CAS Name: 4-[[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-oxomethyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]piperidine-1-carboxylic acid Traditional Name: 4-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]piperidine-1-carboxylic acid Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)C(=O)O

InChI

InChI=1S/C18H21N3O5/c22-16(11-5-7-21(8-6-11)18(25)26)20-15(17(23)24)9-12-10-19-14-4-2-1-3-13(12)14/h1-4,10-11,15,19H,5-9H2,(H,20,22)(H,23,24)(H,25,26)