1-[(4-bromophenyl)methyl]indole-4-carboxylic acid

Systemtic Name: 1-[(4-bromophenyl)methyl]indole-4-carboxylic acid Openeye Name: 1-[(4-bromophenyl)methyl]indole-4-carboxylic acid CAS Name: 1-[(4-bromophenyl)methyl]-4-indolecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)methyl]indole-4-carboxylic acid Traditional Name: 1-(4-bromobenzyl)indole-4-carboxylic acid Formula: C16H12BrNO2 MolecularWeight: 330.17598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CN(C2=C1)CC3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=CC(=C2C=CN(C2=C1)CC3=CC=C(C=C3)Br)C(=O)O

InChI

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