methyl (E)-2-(3,4-dihydro-1H-isochromen-4-yl)but-2-enoate

Systemtic Name: methyl (E)-2-(3,4-dihydro-1H-isochromen-4-yl)but-2-enoate Openeye Name: methyl (E)-2-isochroman-4-ylbut-2-enoate CAS Name: (E)-2-(3,4-dihydro-1H-2-benzopyran-4-yl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-(3,4-dihydro-1H-isochromen-4-yl)but-2-enoate Traditional Name: (E)-2-isochroman-4-ylbut-2-enoic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1COCC2=CC=CC=C12)C(=O)OC

Isomeric SMILES

C/C=C(\C1COCC2=CC=CC=C12)/C(=O)OC

InChI

InChI=1S/C14H16O3/c1-3-11(14(15)16-2)13-9-17-8-10-6-4-5-7-12(10)13/h3-7,13H,8-9H2,1-2H3/b11-3+