[5-ethoxycarbonyl-2-(4-methylphenyl)-1H-indol-3-yl]methyl-dimethyl-azanium

Systemtic Name: [5-ethoxycarbonyl-2-(4-methylphenyl)-1H-indol-3-yl]methyl-dimethyl-azanium Openeye Name: [5-ethoxycarbonyl-2-(p-tolyl)-1H-indol-3-yl]methyl-dimethyl-ammonium CAS Name: [5-ethoxycarbonyl-2-(4-methylphenyl)-1H-indol-3-yl]methyl-dimethylammonium IUPAC Name: [5-ethoxycarbonyl-2-(4-methylphenyl)-1H-indol-3-yl]methyl-dimethylazanium Traditional Name: [5-carbethoxy-2-(p-tolyl)-1H-indol-3-yl]methyl-dimethyl-ammonium Formula: C21H25N2O2+ MolecularWeight: 337.4354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC(=C2C[NH+](C)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC(=C2C[NH+](C)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H24N2O2/c1-5-25-21(24)16-10-11-19-17(12-16)18(13-23(3)4)20(22-19)15-8-6-14(2)7-9-15/h6-12,22H,5,13H2,1-4H3/p+1