N-phenyl-4-[4-(3,5,5-trimethylhexanoylamino)phenyl]piperazine-1-carboxamide

Systemtic Name: N-phenyl-4-[4-(3,5,5-trimethylhexanoylamino)phenyl]piperazine-1-carboxamide Openeye Name: N-phenyl-4-[4-(3,5,5-trimethylhexanoylamino)phenyl]piperazine-1-carboxamide CAS Name: N-phenyl-4-[4-[(3,5,5-trimethyl-1-oxohexyl)amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-phenyl-4-[4-(3,5,5-trimethylhexanoylamino)phenyl]piperazine-1-carboxamide Traditional Name: N-phenyl-4-[4-(3,5,5-trimethylhexanoylamino)phenyl]piperazine-1-carboxamide Formula: C26H36N4O2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=CC=CC=C3)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)NC3=CC=CC=C3)CC(C)(C)C

InChI

InChI=1S/C26H36N4O2/c1-20(19-26(2,3)4)18-24(31)27-22-10-12-23(13-11-22)29-14-16-30(17-15-29)25(32)28-21-8-6-5-7-9-21/h5-13,20H,14-19H2,1-4H3,(H,27,31)(H,28,32)