tert-butyl N-[2-(6-ethynyl-1,3-benzodioxol-5-yl)ethyl]carbamate

Systemtic Name: tert-butyl N-[2-(6-ethynyl-1,3-benzodioxol-5-yl)ethyl]carbamate Openeye Name: tert-butyl N-[2-(6-ethynyl-1,3-benzodioxol-5-yl)ethyl]carbamate CAS Name: N-[2-(6-ethynyl-1,3-benzodioxol-5-yl)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(6-ethynyl-1,3-benzodioxol-5-yl)ethyl]carbamate Traditional Name: N-[2-(6-ethynyl-1,3-benzodioxol-5-yl)ethyl]carbamic acid tert-butyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=CC2=C(C=C1C#C)OCO2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=CC2=C(C=C1C#C)OCO2

InChI

InChI=1S/C16H19NO4/c1-5-11-8-13-14(20-10-19-13)9-12(11)6-7-17-15(18)21-16(2,3)4/h1,8-9H,6-7,10H2,2-4H3,(H,17,18)