3-[2-[[3-(aminomethyl)phenyl]methyl]-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one

Systemtic Name: 3-[2-[[3-(aminomethyl)phenyl]methyl]-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one Openeye Name: 3-[2-[[3-(aminomethyl)phenyl]methyl]-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one CAS Name: 3-[2-[[3-(aminomethyl)phenyl]methyl]-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one IUPAC Name: 3-[2-[[3-(aminomethyl)phenyl]methyl]-1H-indol-3-yl]-3-(1H-indol-3-yl)-1H-imidazol-3-ium-2-one Traditional Name: 1-[2-[3-(aminomethyl)benzyl]-1H-indol-3-yl]-1-(1H-indol-3-yl)-4-imidazolin-1-ium-2-one Formula: C27H24N5O+ MolecularWeight: 434.51236

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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)CC6=CC(=CC=C6)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)[N+]3(C=CNC3=O)C4=C(NC5=CC=CC=C54)CC6=CC(=CC=C6)CN

InChI

InChI=1S/C27H23N5O/c28-16-19-7-5-6-18(14-19)15-24-26(21-9-2-4-11-23(21)31-24)32(13-12-29-27(32)33)25-17-30-22-10-3-1-8-20(22)25/h1-14,17,30-31H,15-16,28H2/p+1