[phenyl-(6-propan-2-yl-1,3-benzodioxol-5-yl)methyl]sulfanyl ethanoate

Systemtic Name: [phenyl-(6-propan-2-yl-1,3-benzodioxol-5-yl)methyl]sulfanyl ethanoate Openeye Name: [(6-isopropyl-1,3-benzodioxol-5-yl)-phenyl-methyl]sulfanyl acetate CAS Name: acetic acid [[phenyl-(6-propan-2-yl-1,3-benzodioxol-5-yl)methyl]thio] ester IUPAC Name: [phenyl-(6-propan-2-yl-1,3-benzodioxol-5-yl)methyl]sulfanyl acetate Traditional Name: acetic acid [[(6-isopropyl-1,3-benzodioxol-5-yl)-phenyl-methyl]thio] ester Formula: C19H20O4S MolecularWeight: 344.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1C(C3=CC=CC=C3)SOC(=O)C)OCO2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1C(C3=CC=CC=C3)SOC(=O)C)OCO2

InChI

InChI=1S/C19H20O4S/c1-12(2)15-9-17-18(22-11-21-17)10-16(15)19(24-23-13(3)20)14-7-5-4-6-8-14/h4-10,12,19H,11H2,1-3H3