N-[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-2-(4-cyclohexylphenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-2-(4-cyclohexylphenoxy)ethanamide Openeye Name: N-[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-2-(4-cyclohexylphenoxy)acetamide CAS Name: N-[3-chloro-4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-2-(4-cyclohexylphenoxy)acetamide IUPAC Name: N-[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-2-(4-cyclohexylphenoxy)acetamide Traditional Name: N-[3-chloro-4-(4-isobutyrylpiperazino)phenyl]-2-(4-cyclohexylphenoxy)acetamide Formula: C28H36ClN3O3 MolecularWeight: 498.05674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)C4CCCCC4)Cl

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)C4CCCCC4)Cl

InChI

InChI=1S/C28H36ClN3O3/c1-20(2)28(34)32-16-14-31(15-17-32)26-13-10-23(18-25(26)29)30-27(33)19-35-24-11-8-22(9-12-24)21-6-4-3-5-7-21/h8-13,18,20-21H,3-7,14-17,19H2,1-2H3,(H,30,33)