(3R)-6-tert-butyl-N-[(E)-pyridin-3-ylmethylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-6-tert-butyl-N-[(E)-pyridin-3-ylmethylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-6-tert-butyl-N-[(E)-3-pyridylmethyleneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-6-tert-butyl-N-[(E)-3-pyridinylmethylideneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-6-tert-butyl-N-[(E)-pyridin-3-ylmethylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-6-tert-butyl-N-[(E)-3-pyridylmethyleneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)NN=CC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC[C@@H](O2)C(=O)N/N=C/C3=CN=CC=C3

InChI

InChI=1S/C19H21N3O3/c1-19(2,3)14-6-7-15-16(9-14)25-17(12-24-15)18(23)22-21-11-13-5-4-8-20-10-13/h4-11,17H,12H2,1-3H3,(H,22,23)/b21-11+/t17-/m1/s1