1-(2-imidazol-1-ylethyl)-2,3-dimethyl-indole-5-carboxylic acid

Systemtic Name: 1-(2-imidazol-1-ylethyl)-2,3-dimethyl-indole-5-carboxylic acid Openeye Name: 1-(2-imidazol-1-ylethyl)-2,3-dimethyl-indole-5-carboxylic acid CAS Name: 1-[2-(1-imidazolyl)ethyl]-2,3-dimethyl-5-indolecarboxylic acid IUPAC Name: 1-(2-imidazol-1-ylethyl)-2,3-dimethylindole-5-carboxylic acid Traditional Name: 1-(2-imidazol-1-ylethyl)-2,3-dimethyl-indole-5-carboxylic acid Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)O)CCN3C=CN=C3)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)O)CCN3C=CN=C3)C

InChI

InChI=1S/C16H17N3O2/c1-11-12(2)19(8-7-18-6-5-17-10-18)15-4-3-13(16(20)21)9-14(11)15/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)