tert-butyl N-[(3S)-7-ethanoyl-3,4-dihydro-2H-chromen-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S)-7-ethanoyl-3,4-dihydro-2H-chromen-3-yl]carbamate Openeye Name: tert-butyl N-[(3S)-7-acetylchroman-3-yl]carbamate CAS Name: N-[(3S)-7-acetyl-3,4-dihydro-2H-1-benzopyran-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S)-7-acetyl-3,4-dihydro-2H-chromen-3-yl]carbamate Traditional Name: N-[(3S)-7-acetylchroman-3-yl]carbamic acid tert-butyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(CC(CO2)NC(=O)OC(C)(C)C)C=C1

Isomeric SMILES

CC(=O)C1=CC2=C(C[C@@H](CO2)NC(=O)OC(C)(C)C)C=C1

InChI

InChI=1S/C16H21NO4/c1-10(18)11-5-6-12-7-13(9-20-14(12)8-11)17-15(19)21-16(2,3)4/h5-6,8,13H,7,9H2,1-4H3,(H,17,19)/t13-/m0/s1