tert-butyl (2S)-4-oxidanylidene-2-phenethyl-2,3-dihydrochromene-3-carboxylate

Systemtic Name: tert-butyl (2S)-4-oxidanylidene-2-phenethyl-2,3-dihydrochromene-3-carboxylate Openeye Name: tert-butyl (2S)-4-oxo-2-phenethyl-chromane-3-carboxylate CAS Name: (2S)-4-oxo-2-phenethyl-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-oxo-2-phenethyl-2,3-dihydrochromene-3-carboxylate Traditional Name: (2S)-4-keto-2-phenethyl-chroman-3-carboxylic acid tert-butyl ester Formula: C22H24O4 MolecularWeight: 352.42356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(OC2=CC=CC=C2C1=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1[C@@H](OC2=CC=CC=C2C1=O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H24O4/c1-22(2,3)26-21(24)19-18(14-13-15-9-5-4-6-10-15)25-17-12-8-7-11-16(17)20(19)23/h4-12,18-19H,13-14H2,1-3H3/t18-,19?/m0/s1