1-[2-(1H-indol-3-yl)ethyl]-4-(phenylcarbonyl)-5-pyridin-1-ium-2-yl-pyrrolidine-2,3-dione

Systemtic Name: 1-[2-(1H-indol-3-yl)ethyl]-4-(phenylcarbonyl)-5-pyridin-1-ium-2-yl-pyrrolidine-2,3-dione Openeye Name: 4-benzoyl-1-[2-(1H-indol-3-yl)ethyl]-5-pyridin-1-ium-2-yl-pyrrolidine-2,3-dione CAS Name: 4-benzoyl-1-[2-(1H-indol-3-yl)ethyl]-5-(2-pyridin-1-iumyl)pyrrolidine-2,3-dione IUPAC Name: 4-benzoyl-1-[2-(1H-indol-3-yl)ethyl]-5-pyridin-1-ium-2-ylpyrrolidine-2,3-dione Traditional Name: 4-benzoyl-1-[2-(1H-indol-3-yl)ethyl]-5-pyridin-1-ium-2-yl-pyrrolidine-2,3-quinone Formula: C26H22N3O3+ MolecularWeight: 424.47118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC3=CNC4=CC=CC=C43)C5=CC=CC=[NH+]5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CCC3=CNC4=CC=CC=C43)C5=CC=CC=[NH+]5

InChI

InChI=1S/C26H21N3O3/c30-24(17-8-2-1-3-9-17)22-23(21-12-6-7-14-27-21)29(26(32)25(22)31)15-13-18-16-28-20-11-5-4-10-19(18)20/h1-12,14,16,22-23,28H,13,15H2/p+1