3,5-ditert-butyl-4-methoxy-N-[1-(4-phenylpiperazin-1-yl)carbonylcyclohexyl]benzamide

Systemtic Name: 3,5-ditert-butyl-4-methoxy-N-[1-(4-phenylpiperazin-1-yl)carbonylcyclohexyl]benzamide Openeye Name: 3,5-ditert-butyl-4-methoxy-N-[1-(4-phenylpiperazine-1-carbonyl)cyclohexyl]benzamide CAS Name: 3,5-ditert-butyl-4-methoxy-N-[1-[oxo-(4-phenyl-1-piperazinyl)methyl]cyclohexyl]benzamide IUPAC Name: 3,5-ditert-butyl-4-methoxy-N-[1-(4-phenylpiperazine-1-carbonyl)cyclohexyl]benzamide Traditional Name: 3,5-ditert-butyl-4-methoxy-N-[1-(4-phenylpiperazine-1-carbonyl)cyclohexyl]benzamide Formula: C33H47N3O3 MolecularWeight: 533.74458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)NC2(CCCCC2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)NC2(CCCCC2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C33H47N3O3/c1-31(2,3)26-22-24(23-27(28(26)39-7)32(4,5)6)29(37)34-33(16-12-9-13-17-33)30(38)36-20-18-35(19-21-36)25-14-10-8-11-15-25/h8,10-11,14-15,22-23H,9,12-13,16-21H2,1-7H3,(H,34,37)