(3,5,5-trimethyl-7-oxidanylidene-oxepan-3-yl) 3-prop-2-enoyloxyadamantane-1-carboxylate

Systemtic Name: (3,5,5-trimethyl-7-oxidanylidene-oxepan-3-yl) 3-prop-2-enoyloxyadamantane-1-carboxylate Openeye Name: (3,5,5-trimethyl-7-oxo-oxepan-3-yl) 3-prop-2-enoyloxyadamantane-1-carboxylate CAS Name: 3-(1-oxoprop-2-enoxy)-1-adamantanecarboxylic acid (3,5,5-trimethyl-7-oxo-3-oxepanyl) ester IUPAC Name: (3,5,5-trimethyl-7-oxooxepan-3-yl) 3-prop-2-enoyloxyadamantane-1-carboxylate Traditional Name: 3-acryloyloxyadamantane-1-carboxylic acid (7-keto-3,5,5-trimethyl-oxepan-3-yl) ester Formula: C23H32O6 MolecularWeight: 404.49658

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)OCC(C1)(C)OC(=O)C23CC4CC(C2)CC(C4)(C3)OC(=O)C=C)C

Isomeric SMILES

CC1(CC(=O)OCC(C1)(C)OC(=O)C23CC4CC(C2)CC(C4)(C3)OC(=O)C=C)C

InChI

InChI=1S/C23H32O6/c1-5-17(24)28-23-9-15-6-16(10-23)8-22(7-15,13-23)19(26)29-21(4)12-20(2,3)11-18(25)27-14-21/h5,15-16H,1,6-14H2,2-4H3