methyl 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]benzoate CAS Name: 2-[4-[(2-butyl-1-benzimidazolyl)methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]benzoate Traditional Name: 2-[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]benzoic acid methyl ester Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C26H26N2O2/c1-3-4-13-25-27-23-11-7-8-12-24(23)28(25)18-19-14-16-20(17-15-19)21-9-5-6-10-22(21)26(29)30-2/h5-12,14-17H,3-4,13,18H2,1-2H3