3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-ethyl-3-methyl-2-phenyl-hexanamide

Systemtic Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-ethyl-3-methyl-2-phenyl-hexanamide Openeye Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-ethyl-3-methyl-2-phenyl-hexanamide CAS Name: 3-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-ethyl-3-methyl-2-phenylhexanamide IUPAC Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-ethyl-3-methyl-2-phenylhexanamide Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazino]-2-ethyl-3-methyl-2-phenyl-hexanamide Formula: C27H39N3O MolecularWeight: 421.61806

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(CC)(C1=CC=CC=C1)C(=O)N)N2CCN(CC2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCC(C)(C(CC)(C1=CC=CC=C1)C(=O)N)N2CCN(CC2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C27H39N3O/c1-6-15-26(5,27(7-2,25(28)31)23-11-9-8-10-12-23)30-18-16-29(17-19-30)24-20-21(3)13-14-22(24)4/h8-14,20H,6-7,15-19H2,1-5H3,(H2,28,31)