[4-[(2S)-butan-2-yl]phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [4-[(2S)-butan-2-yl]phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [4-[(1S)-1-methylpropyl]phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [4-[(2S)-butan-2-yl]phenyl] ester IUPAC Name: [4-[(2S)-butan-2-yl]phenyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [4-[(1S)-1-methylpropyl]phenyl] ester Formula: C19H20O4 MolecularWeight: 312.3597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)OC(=O)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C19H20O4/c1-3-13(2)14-8-10-15(11-9-14)22-19(20)18-12-21-16-6-4-5-7-17(16)23-18/h4-11,13,18H,3,12H2,1-2H3/t13-,18+/m0/s1