3-[(E)-heptadec-8-enyl]isochromen-1-one

Systemtic Name: 3-[(E)-heptadec-8-enyl]isochromen-1-one Openeye Name: 3-[(E)-heptadec-8-enyl]isochromen-1-one CAS Name: 3-[(E)-heptadec-8-enyl]-2-benzopyran-1-one IUPAC Name: 3-[(E)-heptadec-8-enyl]isochromen-1-one Traditional Name: 3-[(E)-heptadec-8-enyl]isocoumarin Formula: C26H38O2 MolecularWeight: 382.57872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC1=CC2=CC=CC=C2C(=O)O1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC1=CC2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C26H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-22-23-19-17-18-21-25(23)26(27)28-24/h9-10,17-19,21-22H,2-8,11-16,20H2,1H3/b10-9+