phenyl (E)-3-methoxy-2-methyl-3-(3-propan-2-ylphenyl)carbonylsulfanyl-prop-2-enoate

Systemtic Name: phenyl (E)-3-methoxy-2-methyl-3-(3-propan-2-ylphenyl)carbonylsulfanyl-prop-2-enoate Openeye Name: phenyl (E)-3-(3-isopropylbenzoyl)sulfanyl-3-methoxy-2-methyl-prop-2-enoate CAS Name: (E)-3-methoxy-2-methyl-3-[[oxo-(3-propan-2-ylphenyl)methyl]thio]-2-propenoic acid phenyl ester IUPAC Name: phenyl (E)-3-methoxy-2-methyl-3-(3-propan-2-ylbenzoyl)sulfanylprop-2-enoate Traditional Name: (E)-3-[(3-isopropylbenzoyl)thio]-3-methoxy-2-methyl-acrylic acid phenyl ester Formula: C21H22O4S MolecularWeight: 370.46198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1)C(=O)SC(=C(C)C(=O)OC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)C1=CC=CC(=C1)C(=O)S/C(=C(\C)/C(=O)OC2=CC=CC=C2)/OC

InChI

InChI=1S/C21H22O4S/c1-14(2)16-9-8-10-17(13-16)20(23)26-21(24-4)15(3)19(22)25-18-11-6-5-7-12-18/h5-14H,1-4H3/b21-15+