butyl (E,5S)-7-naphthalen-1-yl-5-oxidanyl-3-oxidanylidene-hept-6-enoate

Systemtic Name: butyl (E,5S)-7-naphthalen-1-yl-5-oxidanyl-3-oxidanylidene-hept-6-enoate Openeye Name: butyl (E,5S)-5-hydroxy-7-(1-naphthyl)-3-oxo-hept-6-enoate CAS Name: (E,5S)-5-hydroxy-7-(1-naphthalenyl)-3-oxo-6-heptenoic acid butyl ester IUPAC Name: butyl (E,5S)-5-hydroxy-7-naphthalen-1-yl-3-oxohept-6-enoate Traditional Name: (E,5S)-5-hydroxy-3-keto-7-(1-naphthyl)hept-6-enoic acid butyl ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(=O)CC(C=CC1=CC=CC2=CC=CC=C21)O

Isomeric SMILES

CCCCOC(=O)CC(=O)C[C@@H](/C=C/C1=CC=CC2=CC=CC=C21)O

InChI

InChI=1S/C21H24O4/c1-2-3-13-25-21(24)15-19(23)14-18(22)12-11-17-9-6-8-16-7-4-5-10-20(16)17/h4-12,18,22H,2-3,13-15H2,1H3/b12-11+/t18-/m1/s1