5-[[2-methyl-1-(phenylmethyl)benzimidazol-5-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2-methyl-1-(phenylmethyl)benzimidazol-5-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(1-benzyl-2-methyl-benzimidazol-5-yl)amino]-5-oxo-pentanoic acid CAS Name: 5-[[2-methyl-1-(phenylmethyl)-5-benzimidazolyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[(1-benzyl-2-methylbenzimidazol-5-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(1-benzyl-2-methyl-benzimidazol-5-yl)amino]-5-keto-valeric acid Formula: C20H21N3O3 MolecularWeight: 351.39904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)NC(=O)CCCC(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)NC(=O)CCCC(=O)O

InChI

InChI=1S/C20H21N3O3/c1-14-21-17-12-16(22-19(24)8-5-9-20(25)26)10-11-18(17)23(14)13-15-6-3-2-4-7-15/h2-4,6-7,10-12H,5,8-9,13H2,1H3,(H,22,24)(H,25,26)