methyl (E)-4-[4-(2-oxidanylidenepropyl)phenoxy]but-2-enoate

Systemtic Name: methyl (E)-4-[4-(2-oxidanylidenepropyl)phenoxy]but-2-enoate Openeye Name: methyl (E)-4-(4-acetonylphenoxy)but-2-enoate CAS Name: (E)-4-[4-(2-oxopropyl)phenoxy]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[4-(2-oxopropyl)phenoxy]but-2-enoate Traditional Name: (E)-4-(4-acetonylphenoxy)but-2-enoic acid methyl ester Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=CC=C(C=C1)OCC=CC(=O)OC

Isomeric SMILES

CC(=O)CC1=CC=C(C=C1)OC/C=C/C(=O)OC

InChI

InChI=1S/C14H16O4/c1-11(15)10-12-5-7-13(8-6-12)18-9-3-4-14(16)17-2/h3-8H,9-10H2,1-2H3/b4-3+