[9-(2-bromanyl-6-methoxy-phenyl)-7-oxidanyl-9-oxidanylidene-non-1-en-3-yl] ethanoate

Systemtic Name: [9-(2-bromanyl-6-methoxy-phenyl)-7-oxidanyl-9-oxidanylidene-non-1-en-3-yl] ethanoate Openeye Name: [7-(2-bromo-6-methoxy-phenyl)-5-hydroxy-7-oxo-1-vinyl-heptyl] acetate CAS Name: acetic acid [9-(2-bromo-6-methoxyphenyl)-7-hydroxy-9-oxonon-1-en-3-yl] ester IUPAC Name: [9-(2-bromo-6-methoxyphenyl)-7-hydroxy-9-oxonon-1-en-3-yl] acetate Traditional Name: acetic acid 1-[6-(2-bromo-6-methoxy-phenyl)-4-hydroxy-6-keto-hexyl]allyl ester Formula: C18H23BrO5 MolecularWeight: 399.27622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCC(CC(=O)C1=C(C=CC=C1Br)OC)O)C=C

Isomeric SMILES

CC(=O)OC(CCCC(CC(=O)C1=C(C=CC=C1Br)OC)O)C=C

InChI

InChI=1S/C18H23BrO5/c1-4-14(24-12(2)20)8-5-7-13(21)11-16(22)18-15(19)9-6-10-17(18)23-3/h4,6,9-10,13-14,21H,1,5,7-8,11H2,2-3H3