2-[2-butyl-3-[[4-[(2-carboxyphenyl)carbonylamino]phenyl]methyl]-4-chloranyl-5-methyl-4H-imidazol-5-yl]ethanoate

Systemtic Name: 2-[2-butyl-3-[[4-[(2-carboxyphenyl)carbonylamino]phenyl]methyl]-4-chloranyl-5-methyl-4H-imidazol-5-yl]ethanoate Openeye Name: 2-[2-butyl-3-[[4-[(2-carboxybenzoyl)amino]phenyl]methyl]-4-chloro-5-methyl-4H-imidazol-5-yl]acetate CAS Name: 2-[2-butyl-3-[[4-[[(2-carboxyphenyl)-oxomethyl]amino]phenyl]methyl]-4-chloro-5-methyl-4H-imidazol-5-yl]acetate IUPAC Name: 2-[2-butyl-3-[[4-[(2-carboxybenzoyl)amino]phenyl]methyl]-4-chloro-5-methyl-4H-imidazol-5-yl]acetate Traditional Name: 2-[2-butyl-1-[4-[(2-carboxybenzoyl)amino]benzyl]-5-chloro-4-methyl-2-imidazolin-4-yl]acetate Formula: C25H27ClN3O5- MolecularWeight: 484.95198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C(N1CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)Cl)(C)CC(=O)[O-]

Isomeric SMILES

CCCCC1=NC(C(N1CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)Cl)(C)CC(=O)[O-]

InChI

InChI=1S/C25H28ClN3O5/c1-3-4-9-20-28-25(2,14-21(30)31)24(26)29(20)15-16-10-12-17(13-11-16)27-22(32)18-7-5-6-8-19(18)23(33)34/h5-8,10-13,24H,3-4,9,14-15H2,1-2H3,(H,27,32)(H,30,31)(H,33,34)/p-1