(3R)-N-tert-butyl-N-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-tert-butyl-N-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-tert-butyl-N-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-tert-butyl-N-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-tert-butyl-N-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-tert-butyl-N-(1H-imidazol-2-ylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=NC=CN1)C(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)N(CC1=NC=CN1)C(=O)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H21N3O3/c1-17(2,3)20(10-15-18-8-9-19-15)16(21)14-11-22-12-6-4-5-7-13(12)23-14/h4-9,14H,10-11H2,1-3H3,(H,18,19)/t14-/m1/s1