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

Systemtic Name: (6-bromanyl-3-ethoxycarbonyl-1-methyl-5-oxidanyl-indol-2-yl)methyl-methyl-azanium Openeye Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methyl-indol-2-yl)methyl-methyl-ammonium CAS Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methyl-2-indolyl)methyl-methylammonium IUPAC Name: (6-bromo-3-ethoxycarbonyl-5-hydroxy-1-methylindol-2-yl)methyl-methylazanium Traditional Name: (6-bromo-3-carbethoxy-5-hydroxy-1-methyl-indol-2-yl)methyl-methyl-ammonium Formula: C14H18BrN2O3+ MolecularWeight: 342.20832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C)C[NH2+]C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C)C[NH2+]C

InChI

InChI=1S/C14H17BrN2O3/c1-4-20-14(19)13-8-5-12(18)9(15)6-10(8)17(3)11(13)7-16-2/h5-6,16,18H,4,7H2,1-3H3/p+1