[3-chloranyl-4-[(E)-2-cyclopropylcarbonyl-3-ethoxy-prop-2-enoyl]phenyl] methanesulfonate

Systemtic Name: [3-chloranyl-4-[(E)-2-cyclopropylcarbonyl-3-ethoxy-prop-2-enoyl]phenyl] methanesulfonate Openeye Name: [3-chloro-4-[(E)-2-(cyclopropanecarbonyl)-3-ethoxy-prop-2-enoyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-chloro-4-[(E)-2-[cyclopropyl(oxo)methyl]-3-ethoxy-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [3-chloro-4-[(E)-2-(cyclopropanecarbonyl)-3-ethoxyprop-2-enoyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-chloro-4-[(E)-2-(cyclopropanecarbonyl)-3-ethoxy-acryloyl]phenyl] ester Formula: C16H17ClO6S MolecularWeight: 372.82058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C(C(=O)C1CC1)C(=O)C2=C(C=C(C=C2)OS(=O)(=O)C)Cl

Isomeric SMILES

CCO/C=C(\C(=O)C1CC1)/C(=O)C2=C(C=C(C=C2)OS(=O)(=O)C)Cl

InChI

InChI=1S/C16H17ClO6S/c1-3-22-9-13(15(18)10-4-5-10)16(19)12-7-6-11(8-14(12)17)23-24(2,20)21/h6-10H,3-5H2,1-2H3/b13-9+