2-[4-bromanyl-5-oxidanylidene-3-(phenylmethyl)-6-bicyclo[4.2.0]octanyl]ethanoic acid

Systemtic Name: 2-[4-bromanyl-5-oxidanylidene-3-(phenylmethyl)-6-bicyclo[4.2.0]octanyl]ethanoic acid Openeye Name: 2-(3-benzyl-4-bromo-5-oxo-6-bicyclo[4.2.0]octanyl)acetic acid CAS Name: 2-[4-bromo-5-oxo-3-(phenylmethyl)-6-bicyclo[4.2.0]octanyl]acetic acid IUPAC Name: 2-(3-benzyl-4-bromo-5-oxo-6-bicyclo[4.2.0]octanyl)acetic acid Traditional Name: 2-(3-benzyl-4-bromo-5-keto-6-bicyclo[4.2.0]octanyl)acetic acid Formula: C17H19BrO3 MolecularWeight: 351.23496

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1CC(C(C2=O)Br)CC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1CC2(C1CC(C(C2=O)Br)CC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C17H19BrO3/c18-15-12(8-11-4-2-1-3-5-11)9-13-6-7-17(13,16(15)21)10-14(19)20/h1-5,12-13,15H,6-10H2,(H,19,20)