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

Systemtic Name: 3-[3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid Openeye Name: 3-[3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid CAS Name: 3-[3-(1-imidazolylmethyl)-1-indolyl]propanoic acid IUPAC Name: 3-[3-(imidazol-1-ylmethyl)indol-1-yl]propanoic acid Traditional Name: 3-[3-(imidazol-1-ylmethyl)indol-1-yl]propionic acid Formula: C15H15N3O2 MolecularWeight: 269.2985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC(=O)O)CN3C=CN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC(=O)O)CN3C=CN=C3

InChI

InChI=1S/C15H15N3O2/c19-15(20)5-7-18-10-12(9-17-8-6-16-11-17)13-3-1-2-4-14(13)18/h1-4,6,8,10-11H,5,7,9H2,(H,19,20)