ethyl 4-[(5-imidazol-1-yl-2-methyl-phenyl)-oxidanyl-methyl]-3,5-dimethyl-benzoate

Systemtic Name: ethyl 4-[(5-imidazol-1-yl-2-methyl-phenyl)-oxidanyl-methyl]-3,5-dimethyl-benzoate Openeye Name: ethyl 4-[hydroxy-(5-imidazol-1-yl-2-methyl-phenyl)methyl]-3,5-dimethyl-benzoate CAS Name: 4-[hydroxy-[5-(1-imidazolyl)-2-methylphenyl]methyl]-3,5-dimethylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[hydroxy-(5-imidazol-1-yl-2-methylphenyl)methyl]-3,5-dimethylbenzoate Traditional Name: 4-[hydroxy-(5-imidazol-1-yl-2-methyl-phenyl)methyl]-3,5-dimethyl-benzoic acid ethyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)C)C(C2=C(C=CC(=C2)N3C=CN=C3)C)O)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)C)C(C2=C(C=CC(=C2)N3C=CN=C3)C)O)C

InChI

InChI=1S/C22H24N2O3/c1-5-27-22(26)17-10-15(3)20(16(4)11-17)21(25)19-12-18(7-6-14(19)2)24-9-8-23-13-24/h6-13,21,25H,5H2,1-4H3