naphthalen-1-yl 3-oxidanyl-5-oxidanylidene-2-[(E)-prop-1-enyl]heptanoate

Systemtic Name: naphthalen-1-yl 3-oxidanyl-5-oxidanylidene-2-[(E)-prop-1-enyl]heptanoate Openeye Name: 1-naphthyl 3-hydroxy-5-oxo-2-[(E)-prop-1-enyl]heptanoate CAS Name: 3-hydroxy-5-oxo-2-[(E)-prop-1-enyl]heptanoic acid 1-naphthalenyl ester IUPAC Name: naphthalen-1-yl 3-hydroxy-5-oxo-2-[(E)-prop-1-enyl]heptanoate Traditional Name: (E)-2-(1-hydroxy-3-keto-pentyl)pent-3-enoic acid 1-naphthyl ester Formula: C20H22O4 MolecularWeight: 326.38628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(C(C=CC)C(=O)OC1=CC=CC2=CC=CC=C21)O

Isomeric SMILES

CCC(=O)CC(C(/C=C/C)C(=O)OC1=CC=CC2=CC=CC=C21)O

InChI

InChI=1S/C20H22O4/c1-3-8-17(18(22)13-15(21)4-2)20(23)24-19-12-7-10-14-9-5-6-11-16(14)19/h3,5-12,17-18,22H,4,13H2,1-2H3/b8-3+