4-(5-cyano-1-propan-2-yl-benzimidazol-2-yl)benzoic acid

Systemtic Name: 4-(5-cyano-1-propan-2-yl-benzimidazol-2-yl)benzoic acid Openeye Name: 4-(5-cyano-1-isopropyl-benzimidazol-2-yl)benzoic acid CAS Name: 4-(5-cyano-1-propan-2-yl-2-benzimidazolyl)benzoic acid IUPAC Name: 4-(5-cyano-1-propan-2-ylbenzimidazol-2-yl)benzoic acid Traditional Name: 4-(5-cyano-1-isopropyl-benzimidazol-2-yl)benzoic acid Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)C#N)N=C1C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)C#N)N=C1C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H15N3O2/c1-11(2)21-16-8-3-12(10-19)9-15(16)20-17(21)13-4-6-14(7-5-13)18(22)23/h3-9,11H,1-2H3,(H,22,23)