[4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxidanylidene-butyl] 4-chloranylbenzoate

Systemtic Name: [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxidanylidene-butyl] 4-chloranylbenzoate Openeye Name: [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxo-butyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[4-(4-chlorophenyl)phenoxy]-4-(1-imidazolyl)-2,2-dimethyl-3-oxobutyl] ester IUPAC Name: [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-2,2-dimethyl-3-oxobutyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-[4-(4-chlorophenyl)phenoxy]-4-imidazol-1-yl-3-keto-2,2-dimethyl-butyl] ester Formula: C28H24Cl2N2O4 MolecularWeight: 523.40716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC(=O)C1=CC=C(C=C1)Cl)C(=O)C(N2C=CN=C2)OC3=CC=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(COC(=O)C1=CC=C(C=C1)Cl)C(=O)C(N2C=CN=C2)OC3=CC=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H24Cl2N2O4/c1-28(2,17-35-27(34)21-5-11-23(30)12-6-21)25(33)26(32-16-15-31-18-32)36-24-13-7-20(8-14-24)19-3-9-22(29)10-4-19/h3-16,18,26H,17H2,1-2H3