tert-butyl 4-[3-[2-(3-oxidanylphenoxy)ethoxy]pyrazin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[2-(3-oxidanylphenoxy)ethoxy]pyrazin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[2-(3-hydroxyphenoxy)ethoxy]pyrazin-2-yl]piperazine-1-carboxylate CAS Name: 4-[3-[2-(3-hydroxyphenoxy)ethoxy]-2-pyrazinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[2-(3-hydroxyphenoxy)ethoxy]pyrazin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-[2-(3-hydroxyphenoxy)ethoxy]pyrazin-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=CN=C2OCCOC3=CC=CC(=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=CN=C2OCCOC3=CC=CC(=C3)O

InChI

InChI=1S/C21H28N4O5/c1-21(2,3)30-20(27)25-11-9-24(10-12-25)18-19(23-8-7-22-18)29-14-13-28-17-6-4-5-16(26)15-17/h4-8,15,26H,9-14H2,1-3H3