methyl 2-[4-[(6-azanyl-4-methyl-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(6-azanyl-4-methyl-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[(6-amino-4-methyl-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoate CAS Name: 2-[4-[(6-amino-4-methyl-2-propyl-1-benzimidazolyl)methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(6-amino-4-methyl-2-propylbenzimidazol-1-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[(6-amino-4-methyl-2-propyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid methyl ester Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)C=C(C=C2C)N

Isomeric SMILES

CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)C=C(C=C2C)N

InChI

InChI=1S/C26H27N3O2/c1-4-7-24-28-25-17(2)14-20(27)15-23(25)29(24)16-18-10-12-19(13-11-18)21-8-5-6-9-22(21)26(30)31-3/h5-6,8-15H,4,7,16,27H2,1-3H3