3-(1H-indol-3-ylmethyl)-6-(2-methylpropyl)-1-oxidanyl-piperazine-2,5-dione

Systemtic Name: 3-(1H-indol-3-ylmethyl)-6-(2-methylpropyl)-1-oxidanyl-piperazine-2,5-dione Openeye Name: 1-hydroxy-3-(1H-indol-3-ylmethyl)-6-isobutyl-piperazine-2,5-dione CAS Name: 1-hydroxy-3-(1H-indol-3-ylmethyl)-6-(2-methylpropyl)piperazine-2,5-dione IUPAC Name: 1-hydroxy-3-(1H-indol-3-ylmethyl)-6-(2-methylpropyl)piperazine-2,5-dione Traditional Name: 1-hydroxy-3-(1H-indol-3-ylmethyl)-6-isobutyl-piperazine-2,5-quinone Formula: C17H21N3O3 MolecularWeight: 315.36694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC(C(=O)N1O)CC2=CNC3=CC=CC=C32

Isomeric SMILES

CC(C)CC1C(=O)NC(C(=O)N1O)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H21N3O3/c1-10(2)7-15-16(21)19-14(17(22)20(15)23)8-11-9-18-13-6-4-3-5-12(11)13/h3-6,9-10,14-15,18,23H,7-8H2,1-2H3,(H,19,21)