tert-butyl N-[(3R,3aS,7aS)-2-oxidanylidene-7a-phenyl-3,3a,4,5-tetrahydro-1-benzofuran-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3R,3aS,7aS)-2-oxidanylidene-7a-phenyl-3,3a,4,5-tetrahydro-1-benzofuran-3-yl]carbamate Openeye Name: tert-butyl N-[(3R,3aS,7aS)-2-oxo-7a-phenyl-3,3a,4,5-tetrahydrobenzofuran-3-yl]carbamate CAS Name: N-[(3R,3aS,7aS)-2-oxo-7a-phenyl-3,3a,4,5-tetrahydrobenzofuran-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R,3aS,7aS)-2-oxo-7a-phenyl-3,3a,4,5-tetrahydro-1-benzofuran-3-yl]carbamate Traditional Name: N-[(3R,3aS,7aS)-2-keto-7a-phenyl-3,3a,4,5-tetrahydrobenzofuran-3-yl]carbamic acid tert-butyl ester Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1C2CCC=CC2(OC1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCC=C[C@@]2(OC1=O)C3=CC=CC=C3

InChI

InChI=1S/C19H23NO4/c1-18(2,3)24-17(22)20-15-14-11-7-8-12-19(14,23-16(15)21)13-9-5-4-6-10-13/h4-6,8-10,12,14-15H,7,11H2,1-3H3,(H,20,22)/t14-,15+,19+/m0/s1