S-methyl 3-methoxy-4-oxidanylidene-3-[(2E)-penta-2,4-dienoxy]naphthalene-1-carbothioate

Systemtic Name: S-methyl 3-methoxy-4-oxidanylidene-3-[(2E)-penta-2,4-dienoxy]naphthalene-1-carbothioate Openeye Name: S-methyl 3-methoxy-4-oxo-3-[(2E)-penta-2,4-dienoxy]naphthalene-1-carbothioate CAS Name: 3-methoxy-4-oxo-3-[(2E)-penta-2,4-dienoxy]-1-naphthalenecarbothioic acid S-methyl ester IUPAC Name: S-methyl 3-methoxy-4-oxo-3-[(2E)-penta-2,4-dienoxy]naphthalene-1-carbothioate Traditional Name: 4-keto-3-methoxy-3-[(2E)-penta-2,4-dienoxy]naphthalene-1-carbothioic acid S-methyl ester Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C=C(C2=CC=CC=C2C1=O)C(=O)SC)OCC=CC=C

Isomeric SMILES

COC1(C=C(C2=CC=CC=C2C1=O)C(=O)SC)OC/C=C/C=C

InChI

InChI=1S/C18H18O4S/c1-4-5-8-11-22-18(21-2)12-15(17(20)23-3)13-9-6-7-10-14(13)16(18)19/h4-10,12H,1,11H2,2-3H3/b8-5+