5-[2-(2-butyl-4-chloranyl-imidazol-1-yl)-2-(methoxycarbonylamino)ethyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[2-(2-butyl-4-chloranyl-imidazol-1-yl)-2-(methoxycarbonylamino)ethyl]-2-phenyl-benzoic acid Openeye Name: 5-[2-(2-butyl-4-chloro-imidazol-1-yl)-2-(methoxycarbonylamino)ethyl]-2-phenyl-benzoic acid CAS Name: 5-[2-(2-butyl-4-chloro-1-imidazolyl)-2-(methoxycarbonylamino)ethyl]-2-phenylbenzoic acid IUPAC Name: 5-[2-(2-butyl-4-chloroimidazol-1-yl)-2-(methoxycarbonylamino)ethyl]-2-phenylbenzoic acid Traditional Name: 5-[2-(2-butyl-4-chloro-imidazol-1-yl)-2-(carbomethoxyamino)ethyl]-2-phenyl-benzoic acid Formula: C24H26ClN3O4 MolecularWeight: 455.93394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CN1C(CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)NC(=O)OC)Cl

Isomeric SMILES

CCCCC1=NC(=CN1C(CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)NC(=O)OC)Cl

InChI

InChI=1S/C24H26ClN3O4/c1-3-4-10-21-26-20(25)15-28(21)22(27-24(31)32-2)14-16-11-12-18(19(13-16)23(29)30)17-8-6-5-7-9-17/h5-9,11-13,15,22H,3-4,10,14H2,1-2H3,(H,27,31)(H,29,30)