5-bromanyl-3-methoxy-2-(3-phenylpropoxy)benzoic acid

Systemtic Name: 5-bromanyl-3-methoxy-2-(3-phenylpropoxy)benzoic acid Openeye Name: 5-bromo-3-methoxy-2-(3-phenylpropoxy)benzoic acid CAS Name: 5-bromo-3-methoxy-2-(3-phenylpropoxy)benzoic acid IUPAC Name: 5-bromo-3-methoxy-2-(3-phenylpropoxy)benzoic acid Traditional Name: 5-bromo-3-methoxy-2-(3-phenylpropoxy)benzoic acid Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C(=O)O)OCCCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C(=O)O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C17H17BrO4/c1-21-15-11-13(18)10-14(17(19)20)16(15)22-9-5-8-12-6-3-2-4-7-12/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,19,20)