1-ethanoyl-2-(imidazol-1-ylmethyl)-3-methyl-indole-5-carboxylic acid

Systemtic Name: 1-ethanoyl-2-(imidazol-1-ylmethyl)-3-methyl-indole-5-carboxylic acid Openeye Name: 1-acetyl-2-(imidazol-1-ylmethyl)-3-methyl-indole-5-carboxylic acid CAS Name: 1-acetyl-2-(1-imidazolylmethyl)-3-methyl-5-indolecarboxylic acid IUPAC Name: 1-acetyl-2-(imidazol-1-ylmethyl)-3-methylindole-5-carboxylic acid Traditional Name: 1-acetyl-2-(imidazol-1-ylmethyl)-3-methyl-indole-5-carboxylic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)O)C(=O)C)CN3C=CN=C3

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)O)C(=O)C)CN3C=CN=C3

InChI

InChI=1S/C16H15N3O3/c1-10-13-7-12(16(21)22)3-4-14(13)19(11(2)20)15(10)8-18-6-5-17-9-18/h3-7,9H,8H2,1-2H3,(H,21,22)