(6-bromanylnaphthalen-2-yl) 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: (6-bromo-2-naphthyl) 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid (6-bromo-2-naphthyl) ester Formula: C21H19BrO4 MolecularWeight: 415.27716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)OC

InChI

InChI=1S/C21H19BrO4/c1-24-19-9-3-14(11-20(19)25-2)4-10-21(23)26-18-8-6-15-12-17(22)7-5-16(15)13-18/h3,5-9,11-13H,4,10H2,1-2H3