(8-methoxy-3,7-dimethyl-3,4-dihydro-1H-isochromen-6-yl) nonanoate

Systemtic Name: (8-methoxy-3,7-dimethyl-3,4-dihydro-1H-isochromen-6-yl) nonanoate Openeye Name: (8-methoxy-3,7-dimethyl-isochroman-6-yl) nonanoate CAS Name: nonanoic acid (8-methoxy-3,7-dimethyl-3,4-dihydro-1H-2-benzopyran-6-yl) ester IUPAC Name: (8-methoxy-3,7-dimethyl-3,4-dihydro-1H-isochromen-6-yl) nonanoate Traditional Name: pelargonic acid (8-methoxy-3,7-dimethyl-isochroman-6-yl) ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=C(C(=C2COC(CC2=C1)C)OC)C

Isomeric SMILES

CCCCCCCCC(=O)OC1=C(C(=C2COC(CC2=C1)C)OC)C

InChI

InChI=1S/C21H32O4/c1-5-6-7-8-9-10-11-20(22)25-19-13-17-12-15(2)24-14-18(17)21(23-4)16(19)3/h13,15H,5-12,14H2,1-4H3