3-(1H-indol-3-yl)-3-[2-(3-oxidanylpropyl)-1H-indol-3-yl]-1H-imidazol-3-ium-2-one

Systemtic Name: 3-(1H-indol-3-yl)-3-[2-(3-oxidanylpropyl)-1H-indol-3-yl]-1H-imidazol-3-ium-2-one Openeye Name: 3-[2-(3-hydroxypropyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one CAS Name: 3-[2-(3-hydroxypropyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one IUPAC Name: 3-[2-(3-hydroxypropyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one Traditional Name: 1-[2-(3-hydroxypropyl)-1H-indol-3-yl]-1-(1H-indol-3-yl)-4-imidazolin-1-ium-2-one Formula: C22H21N4O2+ MolecularWeight: 373.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)[N+]3(C=CNC3=O)C4=C(NC5=CC=CC=C54)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)[N+]3(C=CNC3=O)C4=C(NC5=CC=CC=C54)CCCO

InChI

InChI=1S/C22H20N4O2/c27-13-5-10-19-21(16-7-2-4-9-18(16)25-19)26(12-11-23-22(26)28)20-14-24-17-8-3-1-6-15(17)20/h1-4,6-9,11-12,14,24-25,27H,5,10,13H2/p+1