ethyl N-[4-chloranyl-1-imidazol-1-yl-3,3-dimethyl-1-(4-phenylphenoxy)butan-2-yl]oxycarbonylcarbamate

Systemtic Name: ethyl N-[4-chloranyl-1-imidazol-1-yl-3,3-dimethyl-1-(4-phenylphenoxy)butan-2-yl]oxycarbonylcarbamate Openeye Name: ethyl N-[3-chloro-1-[imidazol-1-yl-(4-phenylphenoxy)methyl]-2,2-dimethyl-propoxy]carbonylcarbamate CAS Name: N-[[4-chloro-1-(1-imidazolyl)-3,3-dimethyl-1-(4-phenylphenoxy)butan-2-yl]oxy-oxomethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-chloro-1-imidazol-1-yl-3,3-dimethyl-1-(4-phenylphenoxy)butan-2-yl]oxycarbonylcarbamate Traditional Name: N-carbethoxycarbamic acid [3-chloro-1-[imidazol-1-yl-(4-phenylphenoxy)methyl]-2,2-dimethyl-propyl] ester Formula: C25H28ClN3O5 MolecularWeight: 485.95992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)OC(C(N1C=CN=C1)OC2=CC=C(C=C2)C3=CC=CC=C3)C(C)(C)CCl

Isomeric SMILES

CCOC(=O)NC(=O)OC(C(N1C=CN=C1)OC2=CC=C(C=C2)C3=CC=CC=C3)C(C)(C)CCl

InChI

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