2-[[[2-butyl-4-chloranyl-5-(methoxymethyl)imidazol-4-yl]-phenyl-methyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[[2-butyl-4-chloranyl-5-(methoxymethyl)imidazol-4-yl]-phenyl-methyl]carbamoyl]benzoic acid Openeye Name: 2-[[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-4-yl]-phenyl-methyl]carbamoyl]benzoic acid CAS Name: 2-[[[[2-butyl-4-chloro-5-(methoxymethyl)-4-imidazolyl]-phenylmethyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-4-yl]-phenylmethyl]carbamoyl]benzoic acid Traditional Name: 2-[[[2-butyl-4-chloro-5-(methoxymethyl)imidazol-4-yl]-phenyl-methyl]carbamoyl]benzoic acid Formula: C24H26ClN3O4 MolecularWeight: 455.93394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C(=N1)COC)(C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3C(=O)O)Cl

Isomeric SMILES

CCCCC1=NC(C(=N1)COC)(C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3C(=O)O)Cl

InChI

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