[(E,3S,4S)-1-(1,3-dithian-2-yl)-5-oxidanylidene-4-phenylmethoxy-pent-1-en-3-yl] ethanoate

Systemtic Name: [(E,3S,4S)-1-(1,3-dithian-2-yl)-5-oxidanylidene-4-phenylmethoxy-pent-1-en-3-yl] ethanoate Openeye Name: [(E,1S)-1-[(1S)-1-benzyloxy-2-oxo-ethyl]-3-(1,3-dithian-2-yl)allyl] acetate CAS Name: acetic acid [(E,3S,4S)-1-(1,3-dithian-2-yl)-5-oxo-4-phenylmethoxypent-1-en-3-yl] ester IUPAC Name: [(E,3S,4S)-1-(1,3-dithian-2-yl)-5-oxo-4-phenylmethoxypent-1-en-3-yl] acetate Traditional Name: acetic acid [(E,1S)-1-[(1S)-1-benzoxy-2-keto-ethyl]-3-(1,3-dithian-2-yl)allyl] ester Formula: C18H22O4S2 MolecularWeight: 366.49488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C=CC1SCCCS1)C(C=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)O[C@@H](/C=C/C1SCCCS1)[C@@H](C=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22O4S2/c1-14(20)22-16(8-9-18-23-10-5-11-24-18)17(12-19)21-13-15-6-3-2-4-7-15/h2-4,6-9,12,16-18H,5,10-11,13H2,1H3/b9-8+/t16-,17+/m0/s1