2-(4-butan-2-ylphenoxy)-N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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