2-methylsulfanyl-4-phenylmethoxy-3-propyl-benzaldehyde

Systemtic Name: 2-methylsulfanyl-4-phenylmethoxy-3-propyl-benzaldehyde Openeye Name: 4-benzyloxy-2-methylsulfanyl-3-propyl-benzaldehyde CAS Name: 2-(methylthio)-4-phenylmethoxy-3-propylbenzaldehyde IUPAC Name: 2-methylsulfanyl-4-phenylmethoxy-3-propylbenzaldehyde Traditional Name: 4-benzoxy-2-(methylthio)-3-propyl-benzaldehyde Formula: C18H20O2S MolecularWeight: 300.4152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1SC)C=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCC1=C(C=CC(=C1SC)C=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H20O2S/c1-3-7-16-17(11-10-15(12-19)18(16)21-2)20-13-14-8-5-4-6-9-14/h4-6,8-12H,3,7,13H2,1-2H3