(3-ethoxycarbonyl-1-methyl-5-oxidanyl-2-phenyl-indol-4-yl)methyl-dimethyl-azanium

Systemtic Name: (3-ethoxycarbonyl-1-methyl-5-oxidanyl-2-phenyl-indol-4-yl)methyl-dimethyl-azanium Openeye Name: (3-ethoxycarbonyl-5-hydroxy-1-methyl-2-phenyl-indol-4-yl)methyl-dimethyl-ammonium CAS Name: (3-ethoxycarbonyl-5-hydroxy-1-methyl-2-phenyl-4-indolyl)methyl-dimethylammonium IUPAC Name: (3-ethoxycarbonyl-5-hydroxy-1-methyl-2-phenylindol-4-yl)methyl-dimethylazanium Traditional Name: (3-carbethoxy-5-hydroxy-1-methyl-2-phenyl-indol-4-yl)methyl-dimethyl-ammonium Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)C[NH+](C)C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)C[NH+](C)C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3/c1-5-26-21(25)19-18-15(13-22(2)3)17(24)12-11-16(18)23(4)20(19)14-9-7-6-8-10-14/h6-12,24H,5,13H2,1-4H3/p+1