tert-butyl 2-[[2-oxidanylidene-2-(4-pentadecylpiperazin-1-yl)ethyl]amino]benzoate

Systemtic Name: tert-butyl 2-[[2-oxidanylidene-2-(4-pentadecylpiperazin-1-yl)ethyl]amino]benzoate Openeye Name: tert-butyl 2-[[2-oxo-2-(4-pentadecylpiperazin-1-yl)ethyl]amino]benzoate CAS Name: 2-[[2-oxo-2-(4-pentadecyl-1-piperazinyl)ethyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-oxo-2-(4-pentadecylpiperazin-1-yl)ethyl]amino]benzoate Traditional Name: 2-[[2-keto-2-(4-pentadecylpiperazino)ethyl]amino]benzoic acid tert-butyl ester Formula: C32H55N3O3 MolecularWeight: 529.7974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCN1CCN(CC1)C(=O)CNC2=CC=CC=C2C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCN1CCN(CC1)C(=O)CNC2=CC=CC=C2C(=O)OC(C)(C)C

InChI

InChI=1S/C32H55N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-19-22-34-23-25-35(26-24-34)30(36)27-33-29-21-18-17-20-28(29)31(37)38-32(2,3)4/h17-18,20-21,33H,5-16,19,22-27H2,1-4H3