methyl 2-[2-[2-(2-oxidanylpropan-2-yl)phenyl]-1-propyl-3-sulfanylidene-cyclopropyl]ethanoate

Systemtic Name: methyl 2-[2-[2-(2-oxidanylpropan-2-yl)phenyl]-1-propyl-3-sulfanylidene-cyclopropyl]ethanoate Openeye Name: methyl 2-[2-[2-(1-hydroxy-1-methyl-ethyl)phenyl]-1-propyl-3-thioxo-cyclopropyl]acetate CAS Name: 2-[2-[2-(2-hydroxypropan-2-yl)phenyl]-1-propyl-3-sulfanylidenecyclopropyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(2-hydroxypropan-2-yl)phenyl]-1-propyl-3-sulfanylidenecyclopropyl]acetate Traditional Name: 2-[2-[2-(1-hydroxy-1-methyl-ethyl)phenyl]-1-propyl-3-thioxo-cyclopropyl]acetic acid methyl ester Formula: C18H24O3S MolecularWeight: 320.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C1=S)C2=CC=CC=C2C(C)(C)O)CC(=O)OC

Isomeric SMILES

CCCC1(C(C1=S)C2=CC=CC=C2C(C)(C)O)CC(=O)OC

InChI

InChI=1S/C18H24O3S/c1-5-10-18(11-14(19)21-4)15(16(18)22)12-8-6-7-9-13(12)17(2,3)20/h6-9,15,20H,5,10-11H2,1-4H3