3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxy-phenyl]-2-oxidanyl-3-oxidanylidene-propanethial

Systemtic Name: 3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxy-phenyl]-2-oxidanyl-3-oxidanylidene-propanethial Openeye Name: 2-hydroxy-3-(4-methoxy-3-norbornan-2-yloxy-phenyl)-3-oxo-propanethial CAS Name: 3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxyphenyl]-2-hydroxy-3-oxopropanethial IUPAC Name: 3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxyphenyl]-2-hydroxy-3-oxopropanethial Traditional Name: 2-hydroxy-3-keto-3-[4-methoxy-3-(2-norbornyloxy)phenyl]thiopropionaldehyde Formula: C17H20O4S MolecularWeight: 320.4033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(C=S)O)OC2CC3CCC2C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C(C=S)O)OC2CC3CCC2C3

InChI

InChI=1S/C17H20O4S/c1-20-14-5-4-12(17(19)13(18)9-22)8-16(14)21-15-7-10-2-3-11(15)6-10/h4-5,8-11,13,15,18H,2-3,6-7H2,1H3