methyl 3-but-3-ynyl-2-ethanoyl-6-ethynyl-non-8-ynoate

Systemtic Name: methyl 3-but-3-ynyl-2-ethanoyl-6-ethynyl-non-8-ynoate Openeye Name: methyl 2-acetyl-3-but-3-ynyl-6-ethynyl-non-8-ynoate CAS Name: 2-acetyl-3-but-3-ynyl-6-ethynyl-8-nonynoic acid methyl ester IUPAC Name: methyl 2-acetyl-3-but-3-ynyl-6-ethynylnon-8-ynoate Traditional Name: 2-acetyl-3-but-3-ynyl-6-ethynyl-non-8-ynoic acid methyl ester Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O3/c1-6-9-11-16(13-12-15(8-3)10-7-2)17(14(4)19)18(20)21-5/h1-3,15-17H,9-13H2,4-5H3