3,6-bis(1H-indol-3-ylmethyl)-5-methoxy-4-oxidanidyl-1H-pyrazin-4-ium-2-one

Systemtic Name: 3,6-bis(1H-indol-3-ylmethyl)-5-methoxy-4-oxidanidyl-1H-pyrazin-4-ium-2-one Openeye Name: 3,6-bis(1H-indol-3-ylmethyl)-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one CAS Name: 3,6-bis(1H-indol-3-ylmethyl)-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one IUPAC Name: 3,6-bis(1H-indol-3-ylmethyl)-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one Traditional Name: 3,6-bis(1H-indol-3-ylmethyl)-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC(=O)C(=[N+]1[O-])CC2=CNC3=CC=CC=C32)CC4=CNC5=CC=CC=C54

Isomeric SMILES

COC1=C(NC(=O)C(=[N+]1[O-])CC2=CNC3=CC=CC=C32)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C23H20N4O3/c1-30-23-20(10-14-12-24-18-8-4-2-6-16(14)18)26-22(28)21(27(23)29)11-15-13-25-19-9-5-3-7-17(15)19/h2-9,12-13,24-25H,10-11H2,1H3,(H,26,28)