2-[3-(1H-indol-3-ylmethyl)-2,5-bis(oxidanylidene)piperazin-1-yl]pentanoic acid

Systemtic Name: 2-[3-(1H-indol-3-ylmethyl)-2,5-bis(oxidanylidene)piperazin-1-yl]pentanoic acid Openeye Name: 2-[3-(1H-indol-3-ylmethyl)-2,5-dioxo-piperazin-1-yl]pentanoic acid CAS Name: 2-[3-(1H-indol-3-ylmethyl)-2,5-dioxo-1-piperazinyl]pentanoic acid IUPAC Name: 2-[3-(1H-indol-3-ylmethyl)-2,5-dioxopiperazin-1-yl]pentanoic acid Traditional Name: 2-[3-(1H-indol-3-ylmethyl)-2,5-diketo-piperazino]valeric acid Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)N1CC(=O)NC(C1=O)CC2=CNC3=CC=CC=C32

Isomeric SMILES

CCCC(C(=O)O)N1CC(=O)NC(C1=O)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C18H21N3O4/c1-2-5-15(18(24)25)21-10-16(22)20-14(17(21)23)8-11-9-19-13-7-4-3-6-12(11)13/h3-4,6-7,9,14-15,19H,2,5,8,10H2,1H3,(H,20,22)(H,24,25)