2-[2-[3-[(4-bromophenyl)methyl]imidazol-4-yl]ethyl-carboxy-amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[3-[(4-bromophenyl)methyl]imidazol-4-yl]ethyl-carboxy-amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[3-[(4-bromophenyl)methyl]imidazol-4-yl]ethyl-carboxy-amino]-4-methyl-pentanoic acid CAS Name: 2-[2-[3-[(4-bromophenyl)methyl]-4-imidazolyl]ethyl-carboxyamino]-4-methylpentanoic acid IUPAC Name: 2-[2-[3-[(4-bromophenyl)methyl]imidazol-4-yl]ethyl-carboxyamino]-4-methylpentanoic acid Traditional Name: 2-[2-[3-(4-bromobenzyl)imidazol-4-yl]ethyl-carboxy-amino]-4-methyl-valeric acid Formula: C19H24BrN3O4 MolecularWeight: 438.31556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CN=CN1CC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CN=CN1CC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C19H24BrN3O4/c1-13(2)9-17(18(24)25)23(19(26)27)8-7-16-10-21-12-22(16)11-14-3-5-15(20)6-4-14/h3-6,10,12-13,17H,7-9,11H2,1-2H3,(H,24,25)(H,26,27)