methyl 3-butyl-1-methoxy-1H-isochromene-4-carboxylate

Systemtic Name: methyl 3-butyl-1-methoxy-1H-isochromene-4-carboxylate Openeye Name: methyl 3-butyl-1-methoxy-1H-isochromene-4-carboxylate CAS Name: 3-butyl-1-methoxy-1H-2-benzopyran-4-carboxylic acid methyl ester IUPAC Name: methyl 3-butyl-1-methoxy-1H-isochromene-4-carboxylate Traditional Name: 3-butyl-1-methoxy-1H-isochromene-4-carboxylic acid methyl ester Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2C(O1)OC)C(=O)OC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2C(O1)OC)C(=O)OC

InChI

InChI=1S/C16H20O4/c1-4-5-10-13-14(15(17)18-2)11-8-6-7-9-12(11)16(19-3)20-13/h6-9,16H,4-5,10H2,1-3H3