5-bromanyl-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indole-3-carboxylic acid

Systemtic Name: 5-bromanyl-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indole-3-carboxylic acid Openeye Name: 5-bromo-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indole-3-carboxylic acid CAS Name: 5-bromo-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3-indolecarboxylic acid IUPAC Name: 5-bromo-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indole-3-carboxylic acid Traditional Name: 5-bromo-1-(2-imidazolin-2-ylmethyl)indole-3-carboxylic acid Formula: C13H12BrN3O2 MolecularWeight: 322.15728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)CN2C=C(C3=C2C=CC(=C3)Br)C(=O)O

Isomeric SMILES

C1CN=C(N1)CN2C=C(C3=C2C=CC(=C3)Br)C(=O)O

InChI

InChI=1S/C13H12BrN3O2/c14-8-1-2-11-9(5-8)10(13(18)19)6-17(11)7-12-15-3-4-16-12/h1-2,5-6H,3-4,7H2,(H,15,16)(H,18,19)