2-bromanyl-5-methyl-3-[3-[(2,4,6-trimethylphenyl)amino]propyl]imidazole-4-carboxylic acid

Systemtic Name: 2-bromanyl-5-methyl-3-[3-[(2,4,6-trimethylphenyl)amino]propyl]imidazole-4-carboxylic acid Openeye Name: 2-bromo-5-methyl-3-[3-(2,4,6-trimethylanilino)propyl]imidazole-4-carboxylic acid CAS Name: 2-bromo-5-methyl-3-[3-(2,4,6-trimethylanilino)propyl]-4-imidazolecarboxylic acid IUPAC Name: 2-bromo-5-methyl-3-[3-(2,4,6-trimethylanilino)propyl]imidazole-4-carboxylic acid Traditional Name: 2-bromo-3-(3-mesidinopropyl)-5-methyl-imidazole-4-carboxylic acid Formula: C17H22BrN3O2 MolecularWeight: 380.27948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NCCCN2C(=C(N=C2Br)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NCCCN2C(=C(N=C2Br)C)C(=O)O)C

InChI

InChI=1S/C17H22BrN3O2/c1-10-8-11(2)14(12(3)9-10)19-6-5-7-21-15(16(22)23)13(4)20-17(21)18/h8-9,19H,5-7H2,1-4H3,(H,22,23)