phenyl (Z)-2-(bromomethyl)-3-methoxy-but-2-enoate

Systemtic Name: phenyl (Z)-2-(bromomethyl)-3-methoxy-but-2-enoate Openeye Name: phenyl (Z)-2-(bromomethyl)-3-methoxy-but-2-enoate CAS Name: (Z)-2-(bromomethyl)-3-methoxy-2-butenoic acid phenyl ester IUPAC Name: phenyl (Z)-2-(bromomethyl)-3-methoxybut-2-enoate Traditional Name: (Z)-2-(bromomethyl)-3-methoxy-but-2-enoic acid phenyl ester Formula: C12H13BrO3 MolecularWeight: 285.13382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CBr)C(=O)OC1=CC=CC=C1)OC

Isomeric SMILES

C/C(=C(/CBr)\C(=O)OC1=CC=CC=C1)/OC

InChI

InChI=1S/C12H13BrO3/c1-9(15-2)11(8-13)12(14)16-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3/b11-9+