ethyl 4-[2-(2-ethylhexanoylamino)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-ethylhexanoylamino)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2-ethylhexanoylamino)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[(2-ethyl-1-oxohexyl)amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-ethylhexanoylamino)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-ethylhexanoylamino)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C22H33N3O4/c1-4-7-10-17(5-2)20(26)23-19-12-9-8-11-18(19)21(27)24-13-15-25(16-14-24)22(28)29-6-3/h8-9,11-12,17H,4-7,10,13-16H2,1-3H3,(H,23,26)