2-[2-(hydroxymethyl)-3-oxidanyl-propoxy]-4-methoxy-5-thiophen-2-yl-benzaldehyde

Systemtic Name: 2-[2-(hydroxymethyl)-3-oxidanyl-propoxy]-4-methoxy-5-thiophen-2-yl-benzaldehyde Openeye Name: 2-[3-hydroxy-2-(hydroxymethyl)propoxy]-4-methoxy-5-(2-thienyl)benzaldehyde CAS Name: 2-[3-hydroxy-2-(hydroxymethyl)propoxy]-4-methoxy-5-thiophen-2-ylbenzaldehyde IUPAC Name: 2-[3-hydroxy-2-(hydroxymethyl)propoxy]-4-methoxy-5-thiophen-2-ylbenzaldehyde Traditional Name: 2-(3-hydroxy-2-methylol-propoxy)-4-methoxy-5-(2-thienyl)benzaldehyde Formula: C16H18O5S MolecularWeight: 322.37612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=CS2)C=O)OCC(CO)CO

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=CS2)C=O)OCC(CO)CO

InChI

InChI=1S/C16H18O5S/c1-20-15-6-14(21-10-11(7-17)8-18)12(9-19)5-13(15)16-3-2-4-22-16/h2-6,9,11,17-18H,7-8,10H2,1H3