1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5H-benzo[d][1,3]benzodioxocine-11-carboxylate

Systemtic Name: 1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5H-benzo[d][1,3]benzodioxocine-11-carboxylate Openeye Name: 1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5H-benzo[d][1,3]benzodioxocine-11-carboxylate CAS Name: 1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5H-benzo[d][1,3]benzodioxocin-11-carboxylate IUPAC Name: 1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5H-benzo[d][1,3]benzodioxocine-11-carboxylate Traditional Name: 1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5H-benzo[d][1,3]benzodioxocin-11-carboxylate Formula: C21H21O6- MolecularWeight: 369.38784

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CC2=CC=CC3=C2OC(OC4=CC=CC=C4C3)C(=O)[O-])C

Isomeric SMILES

CC1(OCC(O1)CC2=CC=CC3=C2OC(OC4=CC=CC=C4C3)C(=O)[O-])C

InChI

InChI=1S/C21H22O6/c1-21(2)24-12-16(27-21)11-15-8-5-7-14-10-13-6-3-4-9-17(13)25-20(19(22)23)26-18(14)15/h3-9,16,20H,10-12H2,1-2H3,(H,22,23)/p-1