[4-[(dimethylazaniumyl)methyl]-3-ethoxycarbonyl-1,2-dimethyl-5-oxidanyl-indol-6-yl]methyl-dimethyl-azanium

Systemtic Name: [4-[(dimethylazaniumyl)methyl]-3-ethoxycarbonyl-1,2-dimethyl-5-oxidanyl-indol-6-yl]methyl-dimethyl-azanium Openeye Name: [4-[(dimethylammonio)methyl]-3-ethoxycarbonyl-5-hydroxy-1,2-dimethyl-indol-6-yl]methyl-dimethyl-ammonium CAS Name: [4-[(dimethylammonio)methyl]-3-ethoxycarbonyl-5-hydroxy-1,2-dimethyl-6-indolyl]methyl-dimethylammonium IUPAC Name: [4-[(dimethylazaniumyl)methyl]-3-ethoxycarbonyl-5-hydroxy-1,2-dimethylindol-6-yl]methyl-dimethylazanium Traditional Name: [3-carbethoxy-4-[(dimethylammonio)methyl]-5-hydroxy-1,2-dimethyl-indol-6-yl]methyl-dimethyl-ammonium Formula: C19H31N3O3+2 MolecularWeight: 349.46774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O3/c1-8-25-19(24)16-12(2)22(7)15-9-13(10-20(3)4)18(23)14(17(15)16)11-21(5)6/h9,23H,8,10-11H2,1-7H3/p+2