6-(1H-indol-3-ylcarbonyl)-5-methoxy-3-(2-methylpropyl)-4-oxidanidyl-1H-pyrazin-4-ium-2-one

Systemtic Name: 6-(1H-indol-3-ylcarbonyl)-5-methoxy-3-(2-methylpropyl)-4-oxidanidyl-1H-pyrazin-4-ium-2-one Openeye Name: 6-(1H-indole-3-carbonyl)-3-isobutyl-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one CAS Name: 6-[1H-indol-3-yl(oxo)methyl]-5-methoxy-3-(2-methylpropyl)-4-oxido-1H-pyrazin-4-ium-2-one IUPAC Name: 6-(1H-indole-3-carbonyl)-5-methoxy-3-(2-methylpropyl)-4-oxido-1H-pyrazin-4-ium-2-one Traditional Name: 6-(1H-indole-3-carbonyl)-3-isobutyl-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one Formula: C18H19N3O4 MolecularWeight: 341.36116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[N+](C(=C(NC1=O)C(=O)C2=CNC3=CC=CC=C32)OC)[O-]

Isomeric SMILES

CC(C)CC1=[N+](C(=C(NC1=O)C(=O)C2=CNC3=CC=CC=C32)OC)[O-]

InChI

InChI=1S/C18H19N3O4/c1-10(2)8-14-17(23)20-15(18(25-3)21(14)24)16(22)12-9-19-13-7-5-4-6-11(12)13/h4-7,9-10,19H,8H2,1-3H3,(H,20,23)