methyl 2-[4-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]thiophen-2-yl]ethanoate

Systemtic Name: methyl 2-[4-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]thiophen-2-yl]ethanoate Openeye Name: methyl 2-[4-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]-2-thienyl]acetate CAS Name: 2-[4-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]-2-thiophenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]thiophen-2-yl]acetate Traditional Name: 2-[4-[(2,2-dimethyl-1,3-dioxan-5-yl)methyl]-2-thienyl]acetic acid methyl ester Formula: C14H20O4S MolecularWeight: 284.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CC2=CSC(=C2)CC(=O)OC)C

Isomeric SMILES

CC1(OCC(CO1)CC2=CSC(=C2)CC(=O)OC)C

InChI

InChI=1S/C14H20O4S/c1-14(2)17-7-11(8-18-14)4-10-5-12(19-9-10)6-13(15)16-3/h5,9,11H,4,6-8H2,1-3H3