3-methylsulfanyl-5-phenylmethoxy-4-propoxy-benzaldehyde

Systemtic Name: 3-methylsulfanyl-5-phenylmethoxy-4-propoxy-benzaldehyde Openeye Name: 3-benzyloxy-5-methylsulfanyl-4-propoxy-benzaldehyde CAS Name: 3-(methylthio)-5-phenylmethoxy-4-propoxybenzaldehyde IUPAC Name: 3-methylsulfanyl-5-phenylmethoxy-4-propoxybenzaldehyde Traditional Name: 3-benzoxy-5-(methylthio)-4-propoxy-benzaldehyde Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1SC)C=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCOC1=C(C=C(C=C1SC)C=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H20O3S/c1-3-9-20-18-16(10-15(12-19)11-17(18)22-2)21-13-14-7-5-4-6-8-14/h4-8,10-12H,3,9,13H2,1-2H3