2-[(5-bromanylindol-1-yl)methyl]benzoic acid

Systemtic Name: 2-[(5-bromanylindol-1-yl)methyl]benzoic acid Openeye Name: 2-[(5-bromoindol-1-yl)methyl]benzoic acid CAS Name: 2-[(5-bromo-1-indolyl)methyl]benzoic acid IUPAC Name: 2-[(5-bromoindol-1-yl)methyl]benzoic acid Traditional Name: 2-[(5-bromoindol-1-yl)methyl]benzoic acid Formula: C16H12BrNO2 MolecularWeight: 330.17598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC3=C2C=CC(=C3)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC3=C2C=CC(=C3)Br)C(=O)O

InChI

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