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2-[4-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid

2-[4-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid

Systemtic Name:2-[4-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid
Openeye Name:2-[4-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid
CAS Name:2-[4-[(6-acetamido-2-butyl-1-benzimidazolyl)methyl]phenyl]benzoic acid
IUPAC Name:2-[4-[(6-acetamido-2-butylbenzimidazol-1-yl)methyl]phenyl]benzoic acid
Traditional Name:2-[4-[(6-acetamido-2-butyl-benzimidazol-1-yl)methyl]phenyl]benzoic acid
Formula: C27H27N3O3
MolecularWeight: 441.52158
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C=C2)NC(=O)C


Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=C(C=C2)NC(=O)C


InChI

InChI=1S/C27H27N3O3/c1-3-4-9-26-29-24-15-14-21(28-18(2)31)16-25(24)30(26)17-19-10-12-20(13-11-19)22-7-5-6-8-23(22)27(32)33/h5-8,10-16H,3-4,9,17H2,1-2H3,(H,28,31)(H,32,33)


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