[2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethoxy]-5-pyrazin-2-yl-phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethoxy]-5-pyrazin-2-yl-phenyl]methyl-dimethyl-azanium Openeye Name: [2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethoxy]-5-pyrazin-2-yl-phenyl]methyl-dimethyl-ammonium CAS Name: [2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethoxy]-5-(2-pyrazinyl)phenyl]methyl-dimethylammonium IUPAC Name: [2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethoxy]-5-pyrazin-2-ylphenyl]methyl-dimethylazanium Traditional Name: [2-[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethoxy]-5-pyrazin-2-yl-benzyl]-dimethyl-ammonium Formula: C25H28N5O2+ MolecularWeight: 430.52212

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC(=C1)C2=NC=CN=C2)OCC(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)C2=NC=CN=C2)OCC(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H27N5O2/c1-30(2)16-20-13-18(23-15-26-11-12-27-23)7-8-24(20)32-17-25(31)28-10-9-19-14-29-22-6-4-3-5-21(19)22/h3-8,11-15,29H,9-10,16-17H2,1-2H3,(H,28,31)/p+1