(2R)-2-[2-(3-azanyl-4-methyl-phenyl)benzimidazol-1-yl]propanoic acid

Systemtic Name: (2R)-2-[2-(3-azanyl-4-methyl-phenyl)benzimidazol-1-yl]propanoic acid Openeye Name: (2R)-2-[2-(3-amino-4-methyl-phenyl)benzimidazol-1-yl]propanoic acid CAS Name: (2R)-2-[2-(3-amino-4-methylphenyl)-1-benzimidazolyl]propanoic acid IUPAC Name: (2R)-2-[2-(3-amino-4-methylphenyl)benzimidazol-1-yl]propanoic acid Traditional Name: (2R)-2-[2-(3-amino-4-methyl-phenyl)benzimidazol-1-yl]propionic acid Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2C(C)C(=O)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2[C@H](C)C(=O)O)N

InChI

InChI=1S/C17H17N3O2/c1-10-7-8-12(9-13(10)18)16-19-14-5-3-4-6-15(14)20(16)11(2)17(21)22/h3-9,11H,18H2,1-2H3,(H,21,22)/t11-/m1/s1