tert-butyl N-[(3-methyl-6-phenylmethoxy-4,5,6,7-tetrahydro-2-benzofuran-1-yl)methyl]-N-prop-2-ynyl-carbamate

Systemtic Name: tert-butyl N-[(3-methyl-6-phenylmethoxy-4,5,6,7-tetrahydro-2-benzofuran-1-yl)methyl]-N-prop-2-ynyl-carbamate Openeye Name: tert-butyl N-[(6-benzyloxy-3-methyl-4,5,6,7-tetrahydroisobenzofuran-1-yl)methyl]-N-prop-2-ynyl-carbamate CAS Name: N-[(3-methyl-6-phenylmethoxy-4,5,6,7-tetrahydroisobenzofuran-1-yl)methyl]-N-prop-2-ynylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-methyl-6-phenylmethoxy-4,5,6,7-tetrahydro-2-benzofuran-1-yl)methyl]-N-prop-2-ynylcarbamate Traditional Name: N-[(6-benzoxy-3-methyl-4,5,6,7-tetrahydroisobenzofuran-1-yl)methyl]-N-propargyl-carbamic acid tert-butyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(CC2=C(O1)CN(CC#C)C(=O)OC(C)(C)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C2CCC(CC2=C(O1)CN(CC#C)C(=O)OC(C)(C)C)OCC3=CC=CC=C3

InChI

InChI=1S/C25H31NO4/c1-6-14-26(24(27)30-25(3,4)5)16-23-22-15-20(12-13-21(22)18(2)29-23)28-17-19-10-8-7-9-11-19/h1,7-11,20H,12-17H2,2-5H3