methyl 5-bromanyl-1-phenyl-indole-2-carboxylate

Systemtic Name: methyl 5-bromanyl-1-phenyl-indole-2-carboxylate Openeye Name: methyl 5-bromo-1-phenyl-indole-2-carboxylate CAS Name: 5-bromo-1-phenyl-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-1-phenylindole-2-carboxylate Traditional Name: 5-bromo-1-phenyl-indole-2-carboxylic acid methyl ester Formula: C16H12BrNO2 MolecularWeight: 330.17598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1C3=CC=CC=C3)C=CC(=C2)Br

Isomeric SMILES

COC(=O)C1=CC2=C(N1C3=CC=CC=C3)C=CC(=C2)Br

InChI

InChI=1S/C16H12BrNO2/c1-20-16(19)15-10-11-9-12(17)7-8-14(11)18(15)13-5-3-2-4-6-13/h2-10H,1H3