(2-methanoylnaphthalen-1-yl) 3-bromanyl-4-propan-2-yloxy-benzoate

Systemtic Name: (2-methanoylnaphthalen-1-yl) 3-bromanyl-4-propan-2-yloxy-benzoate Openeye Name: (2-formyl-1-naphthyl) 3-bromo-4-isopropoxy-benzoate CAS Name: 3-bromo-4-propan-2-yloxybenzoic acid (2-formyl-1-naphthalenyl) ester IUPAC Name: (2-formylnaphthalen-1-yl) 3-bromo-4-propan-2-yloxybenzoate Traditional Name: 3-bromo-4-isopropoxy-benzoic acid (2-formyl-1-naphthyl) ester Formula: C21H17BrO4 MolecularWeight: 413.26128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)OC2=C(C=CC3=CC=CC=C32)C=O)Br

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)OC2=C(C=CC3=CC=CC=C32)C=O)Br

InChI

InChI=1S/C21H17BrO4/c1-13(2)25-19-10-9-15(11-18(19)22)21(24)26-20-16(12-23)8-7-14-5-3-4-6-17(14)20/h3-13H,1-2H3