ethyl 1-[(E)-2-ethoxycarbonyl-4-oxidanylidene-pent-1-enyl]-1H-isochromene-4-carboxylate

Systemtic Name: ethyl 1-[(E)-2-ethoxycarbonyl-4-oxidanylidene-pent-1-enyl]-1H-isochromene-4-carboxylate Openeye Name: ethyl 1-[(E)-2-ethoxycarbonyl-4-oxo-pent-1-enyl]-1H-isochromene-4-carboxylate CAS Name: 1-[(E)-2-ethoxycarbonyl-4-oxopent-1-enyl]-1H-2-benzopyran-4-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-2-ethoxycarbonyl-4-oxopent-1-enyl]-1H-isochromene-4-carboxylate Traditional Name: 1-[(E)-2-carbethoxy-4-keto-pent-1-enyl]-1H-isochromene-4-carboxylic acid ethyl ester Formula: C20H22O6 MolecularWeight: 358.38508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=COC(C2=CC=CC=C21)C=C(CC(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=COC(C2=CC=CC=C21)/C=C(\CC(=O)C)/C(=O)OCC

InChI

InChI=1S/C20H22O6/c1-4-24-19(22)14(10-13(3)21)11-18-16-9-7-6-8-15(16)17(12-26-18)20(23)25-5-2/h6-9,11-12,18H,4-5,10H2,1-3H3/b14-11+