2-(2,4-ditert-butylphenoxy)-N-[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]ethanamide

Systemtic Name: 2-(2,4-ditert-butylphenoxy)-N-[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]ethanamide Openeye Name: N-[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide CAS Name: 2-(2,4-ditert-butylphenoxy)-N-[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]phenyl]acetamide IUPAC Name: N-[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide Traditional Name: N-[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide Formula: C40H47N3O3 MolecularWeight: 617.81948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(C)(C)C

InChI

InChI=1S/C40H47N3O3/c1-39(2,3)31-21-22-35(33(27-31)40(4,5)6)46-28-36(44)41-34-20-14-13-19-32(34)38(45)43-25-23-42(24-26-43)37(29-15-9-7-10-16-29)30-17-11-8-12-18-30/h7-22,27,37H,23-26,28H2,1-6H3,(H,41,44)