(1-bromanylnaphthalen-2-yl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (1-bromanylnaphthalen-2-yl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (1-bromo-2-naphthyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (1-bromo-2-naphthalenyl) ester IUPAC Name: (1-bromonaphthalen-2-yl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (1-bromo-2-naphthyl) ester Formula: C21H18Br2O3 MolecularWeight: 478.17382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)Br)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)Br)Br

InChI

InChI=1S/C21H18Br2O3/c1-2-3-12-25-18-10-9-15(13-17(18)22)21(24)26-19-11-8-14-6-4-5-7-16(14)20(19)23/h4-11,13H,2-3,12H2,1H3