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

Systemtic Name: (2-methanoylnaphthalen-1-yl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (2-formyl-1-naphthyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (2-formyl-1-naphthalenyl) ester IUPAC Name: (2-formylnaphthalen-1-yl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (2-formyl-1-naphthyl) ester Formula: C22H19BrO4 MolecularWeight: 427.28786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C=CC3=CC=CC=C32)C=O)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C=CC3=CC=CC=C32)C=O)Br

InChI

InChI=1S/C22H19BrO4/c1-2-3-12-26-20-11-10-16(13-19(20)23)22(25)27-21-17(14-24)9-8-15-6-4-5-7-18(15)21/h4-11,13-14H,2-3,12H2,1H3