2-[5-bromanyl-3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid

Systemtic Name: 2-[5-bromanyl-3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid Openeye Name: 2-[5-bromo-3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid CAS Name: 2-[5-bromo-3-(1-imidazolylmethyl)-1-indolyl]propanoic acid IUPAC Name: 2-[5-bromo-3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid Traditional Name: 2-[5-bromo-3-(imidazol-1-ylmethyl)indol-1-yl]propionic acid Formula: C15H14BrN3O2 MolecularWeight: 348.19456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C=C(C2=C1C=CC(=C2)Br)CN3C=CN=C3

Isomeric SMILES

CC(C(=O)O)N1C=C(C2=C1C=CC(=C2)Br)CN3C=CN=C3

InChI

InChI=1S/C15H14BrN3O2/c1-10(15(20)21)19-8-11(7-18-5-4-17-9-18)13-6-12(16)2-3-14(13)19/h2-6,8-10H,7H2,1H3,(H,20,21)