(6-bromanyl-3-ethoxycarbonyl-1-methyl-5-oxidanyl-indol-2-yl)methyl-(2-hydroxyethyl)-methyl-azanium

Systemtic Name: (6-bromanyl-3-ethoxycarbonyl-1-methyl-5-oxidanyl-indol-2-yl)methyl-(2-hydroxyethyl)-methyl-azanium Openeye Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methyl-indol-2-yl)methyl-(2-hydroxyethyl)-methyl-ammonium CAS Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methyl-2-indolyl)methyl-(2-hydroxyethyl)-methylammonium IUPAC Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methylindol-2-yl)methyl-(2-hydroxyethyl)-methylazanium Traditional Name: (6-bromo-3-carbethoxy-5-hydroxy-1-methyl-indol-2-yl)methyl-(2-hydroxyethyl)-methyl-ammonium Formula: C16H22BrN2O4+ MolecularWeight: 386.26088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C)C[NH+](C)CCO

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C)C[NH+](C)CCO

InChI

InChI=1S/C16H21BrN2O4/c1-4-23-16(22)15-10-7-14(21)11(17)8-12(10)19(3)13(15)9-18(2)5-6-20/h7-8,20-21H,4-6,9H2,1-3H3/p+1