3-(2-azaniumylethyl)-5-bromanyl-1H-indole-2-carboxylate

Systemtic Name: 3-(2-azaniumylethyl)-5-bromanyl-1H-indole-2-carboxylate Openeye Name: 3-(2-azaniumylethyl)-5-bromo-1H-indole-2-carboxylate CAS Name: 3-(2-ammonioethyl)-5-bromo-1H-indole-2-carboxylate IUPAC Name: 3-(2-azaniumylethyl)-5-bromo-1H-indole-2-carboxylate Traditional Name: 3-(2-ammonioethyl)-5-bromo-1H-indole-2-carboxylate Formula: C11H11BrN2O2 MolecularWeight: 283.12124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=C(N2)C(=O)[O-])CC[NH3+]

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=C(N2)C(=O)[O-])CC[NH3+]

InChI

InChI=1S/C11H11BrN2O2/c12-6-1-2-9-8(5-6)7(3-4-13)10(14-9)11(15)16/h1-2,5,14H,3-4,13H2,(H,15,16)