[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 3-methyl-4-nitro-benzoate

Systemtic Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 3-methyl-4-nitro-benzoate Openeye Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester IUPAC Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC2COC3=CC=CC=C3O2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC[C@H]2COC3=CC=CC=C3O2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-11-8-12(6-7-14(11)18(20)21)17(19)23-10-13-9-22-15-4-2-3-5-16(15)24-13/h2-8,13H,9-10H2,1H3/t13-/m1/s1