[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [(1R)-1-(benzylcarbamoyl)propyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [(2R)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [(2R)-1-(benzylamino)-1-oxobutan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [(1R)-1-(benzylcarbamoyl)propyl] ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CC[C@H](C(=O)NCC1=CC=CC=C1)OC(=O)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H21NO5/c1-2-15(19(22)21-12-14-8-4-3-5-9-14)26-20(23)18-13-24-16-10-6-7-11-17(16)25-18/h3-11,15,18H,2,12-13H2,1H3,(H,21,22)/t15-,18-/m1/s1