N-butyl-4-[4-[[(2S)-2-ethylhexanoyl]amino]phenyl]piperazine-1-carboxamide

Systemtic Name: N-butyl-4-[4-[[(2S)-2-ethylhexanoyl]amino]phenyl]piperazine-1-carboxamide Openeye Name: N-butyl-4-[4-[[(2S)-2-ethylhexanoyl]amino]phenyl]piperazine-1-carboxamide CAS Name: N-butyl-4-[4-[[(2S)-2-ethyl-1-oxohexyl]amino]phenyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[4-[[(2S)-2-ethylhexanoyl]amino]phenyl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[4-[[(2S)-2-ethylhexanoyl]amino]phenyl]piperazine-1-carboxamide Formula: C23H38N4O2 MolecularWeight: 402.57342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)NCCCC

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)NCCCC

InChI

InChI=1S/C23H38N4O2/c1-4-7-9-19(6-3)22(28)25-20-10-12-21(13-11-20)26-15-17-27(18-16-26)23(29)24-14-8-5-2/h10-13,19H,4-9,14-18H2,1-3H3,(H,24,29)(H,25,28)/t19-/m0/s1