5-(bromomethyl)-1-phenyl-indole-2-carboxylic acid

Systemtic Name: 5-(bromomethyl)-1-phenyl-indole-2-carboxylic acid Openeye Name: 5-(bromomethyl)-1-phenyl-indole-2-carboxylic acid CAS Name: 5-(bromomethyl)-1-phenyl-2-indolecarboxylic acid IUPAC Name: 5-(bromomethyl)-1-phenylindole-2-carboxylic acid Traditional Name: 5-(bromomethyl)-1-phenyl-indole-2-carboxylic acid Formula: C16H12BrNO2 MolecularWeight: 330.17598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)CBr)C=C2C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)CBr)C=C2C(=O)O

InChI

InChI=1S/C16H12BrNO2/c17-10-11-6-7-14-12(8-11)9-15(16(19)20)18(14)13-4-2-1-3-5-13/h1-9H,10H2,(H,19,20)