N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2-(2-isopropyl-5-methyl-phenoxy)acetamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]-2-(2-isopropyl-5-methyl-phenoxy)acetamide Formula: C27H36ClN3O3 MolecularWeight: 486.04604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)CC(C)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)CC(C)C)Cl

InChI

InChI=1S/C27H36ClN3O3/c1-18(2)14-27(33)31-12-10-30(11-13-31)24-9-7-21(16-23(24)28)29-26(32)17-34-25-15-20(5)6-8-22(25)19(3)4/h6-9,15-16,18-19H,10-14,17H2,1-5H3,(H,29,32)