tert-butyl 4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCOC2=CC=C(C=C2)C3=CC=NN3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCOC2=CC=C(C=C2)C3=CC=NN3

InChI

InChI=1S/C20H28N4O3/c1-20(2,3)27-19(25)24-12-10-23(11-13-24)14-15-26-17-6-4-16(5-7-17)18-8-9-21-22-18/h4-9H,10-15H2,1-3H3,(H,21,22)