(3R)-N-[(2S)-octan-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[(2S)-octan-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[(1S)-1-methylheptyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[(2S)-octan-2-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[(2S)-octan-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[(1S)-1-methylheptyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)C1COC2=CC=CC=C2O1

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)[C@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C17H25NO3/c1-3-4-5-6-9-13(2)18-17(19)16-12-20-14-10-7-8-11-15(14)21-16/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3,(H,18,19)/t13-,16+/m0/s1