4-[(5-bromanylindol-1-yl)methyl]benzoate

Systemtic Name: 4-[(5-bromanylindol-1-yl)methyl]benzoate Openeye Name: 4-[(5-bromoindol-1-yl)methyl]benzoate CAS Name: 4-[(5-bromo-1-indolyl)methyl]benzoate IUPAC Name: 4-[(5-bromoindol-1-yl)methyl]benzoate Traditional Name: 4-[(5-bromoindol-1-yl)methyl]benzoate Formula: C16H11BrNO2- MolecularWeight: 329.16804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC3=C2C=CC(=C3)Br)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC3=C2C=CC(=C3)Br)C(=O)[O-]

InChI

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