octa-1,4,7-triyn-3-yl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Systemtic Name: octa-1,4,7-triyn-3-yl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Openeye Name: 1-ethynylhexa-2,5-diynyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid octa-1,4,7-triyn-3-yl ester IUPAC Name: octa-1,4,7-triyn-3-yl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Traditional Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid 1-ethynylhexa-2,5-diynyl ester Formula: C18H20O2 MolecularWeight: 268.3502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)C(=O)OC(C#C)C#CCC#C)C

Isomeric SMILES

CC(=CC1C(C1(C)C)C(=O)OC(C#C)C#CCC#C)C

InChI

InChI=1S/C18H20O2/c1-7-9-10-11-14(8-2)20-17(19)16-15(12-13(3)4)18(16,5)6/h1-2,12,14-16H,9H2,3-6H3