3-[[1-(4-phenylbutyl)-2-(3-phenylpropyl)benzimidazol-5-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[1-(4-phenylbutyl)-2-(3-phenylpropyl)benzimidazol-5-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-(4-phenylbutyl)-2-(3-phenylpropyl)benzimidazole-5-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[1-(4-phenylbutyl)-2-(3-phenylpropyl)-5-benzimidazolyl]methyl]amino]propanoic acid IUPAC Name: 3-[[1-(4-phenylbutyl)-2-(3-phenylpropyl)benzimidazole-5-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-(4-phenylbutyl)-2-(3-phenylpropyl)benzimidazole-5-carbonyl]amino]propionic acid Formula: C30H33N3O3 MolecularWeight: 483.60132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCN2C3=C(C=C(C=C3)C(=O)NCCC(=O)O)N=C2CCCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCCN2C3=C(C=C(C=C3)C(=O)NCCC(=O)O)N=C2CCCC4=CC=CC=C4

InChI

InChI=1S/C30H33N3O3/c34-29(35)19-20-31-30(36)25-17-18-27-26(22-25)32-28(16-9-15-24-12-5-2-6-13-24)33(27)21-8-7-14-23-10-3-1-4-11-23/h1-6,10-13,17-18,22H,7-9,14-16,19-21H2,(H,31,36)(H,34,35)