tert-butyl 4-(1,3-benzodioxol-5-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(1,3-benzodioxol-5-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(1,3-benzodioxol-5-yl)piperazine-1-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1,3-benzodioxol-5-yl)piperazine-1-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N2O4/c1-16(2,3)22-15(19)18-8-6-17(7-9-18)12-4-5-13-14(10-12)21-11-20-13/h4-5,10H,6-9,11H2,1-3H3