[4-(phenylcarbonyl)-1-prop-2-ynoxycarbonyloxy-cyclohexa-2,5-dien-1-yl] prop-2-ynyl carbonate

Systemtic Name: [4-(phenylcarbonyl)-1-prop-2-ynoxycarbonyloxy-cyclohexa-2,5-dien-1-yl] prop-2-ynyl carbonate Openeye Name: (4-benzoyl-1-prop-2-ynoxycarbonyloxy-cyclohexa-2,5-dien-1-yl) prop-2-ynyl carbonate CAS Name: carbonic acid [4-benzoyl-1-[oxo(prop-2-ynoxy)methoxy]-1-cyclohexa-2,5-dienyl] prop-2-ynyl ester IUPAC Name: (4-benzoyl-1-prop-2-ynoxycarbonyloxycyclohexa-2,5-dien-1-yl) prop-2-ynyl carbonate Traditional Name: carbonic acid (4-benzoyl-1-propargyloxycarbonyloxy-cyclohexa-2,5-dien-1-yl) propargyl ester Formula: C21H16O7 MolecularWeight: 380.34754

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)OC1(C=CC(C=C1)C(=O)C2=CC=CC=C2)OC(=O)OCC#C

Isomeric SMILES

C#CCOC(=O)OC1(C=CC(C=C1)C(=O)C2=CC=CC=C2)OC(=O)OCC#C

InChI

InChI=1S/C21H16O7/c1-3-14-25-19(23)27-21(28-20(24)26-15-4-2)12-10-17(11-13-21)18(22)16-8-6-5-7-9-16/h1-2,5-13,17H,14-15H2