(2S)-2,4-dimethyl-5-[(E)-tetradec-12-enoyl]-2,3-dihydropyran-6-one

Systemtic Name: (2S)-2,4-dimethyl-5-[(E)-tetradec-12-enoyl]-2,3-dihydropyran-6-one Openeye Name: (2S)-2,4-dimethyl-5-[(E)-tetradec-12-enoyl]-2,3-dihydropyran-6-one CAS Name: (2S)-2,4-dimethyl-5-[(E)-1-oxotetradec-12-enyl]-2,3-dihydropyran-6-one IUPAC Name: (2S)-2,4-dimethyl-5-[(E)-tetradec-12-enoyl]-2,3-dihydropyran-6-one Traditional Name: (2S)-2,4-dimethyl-5-[(E)-tetradec-12-enoyl]-2,3-dihydropyran-6-one Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCCCCCCCCCC(=O)C1=C(CC(OC1=O)C)C

Isomeric SMILES

C/C=C/CCCCCCCCCCC(=O)C1=C(C[C@@H](OC1=O)C)C

InChI

InChI=1S/C21H34O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-19(22)20-17(2)16-18(3)24-21(20)23/h4-5,18H,6-16H2,1-3H3/b5-4+/t18-/m0/s1