3-(hydroxymethyl)-6-(1H-indol-3-ylmethyl)-9-methyl-1,4,7-triazonane-2,5,8-trione

Systemtic Name: 3-(hydroxymethyl)-6-(1H-indol-3-ylmethyl)-9-methyl-1,4,7-triazonane-2,5,8-trione Openeye Name: 3-(hydroxymethyl)-6-(1H-indol-3-ylmethyl)-9-methyl-1,4,7-triazonane-2,5,8-trione CAS Name: 3-(hydroxymethyl)-6-(1H-indol-3-ylmethyl)-9-methyl-1,4,7-triazonane-2,5,8-trione IUPAC Name: 3-(hydroxymethyl)-6-(1H-indol-3-ylmethyl)-9-methyl-1,4,7-triazonane-2,5,8-trione Traditional Name: 3-(1H-indol-3-ylmethyl)-6-methyl-9-methylol-1,4,7-triazonane-2,5,8-trione Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(C(=O)NC(C(=O)N1)CO)CC2=CNC3=CC=CC=C32

Isomeric SMILES

CC1C(=O)NC(C(=O)NC(C(=O)N1)CO)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H20N4O4/c1-9-15(23)20-13(16(24)21-14(8-22)17(25)19-9)6-10-7-18-12-5-3-2-4-11(10)12/h2-5,7,9,13-14,18,22H,6,8H2,1H3,(H,19,25)(H,20,23)(H,21,24)