naphthalen-2-yl 3-bromanyl-4-phenethyloxy-benzoate

Systemtic Name: naphthalen-2-yl 3-bromanyl-4-phenethyloxy-benzoate Openeye Name: 2-naphthyl 3-bromo-4-phenethyloxy-benzoate CAS Name: 3-bromo-4-phenethyloxybenzoic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 3-bromo-4-phenethyloxybenzoate Traditional Name: 3-bromo-4-phenethyloxy-benzoic acid 2-naphthyl ester Formula: C25H19BrO3 MolecularWeight: 447.32056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)OC3=CC4=CC=CC=C4C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)OC3=CC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C25H19BrO3/c26-23-17-21(11-13-24(23)28-15-14-18-6-2-1-3-7-18)25(27)29-22-12-10-19-8-4-5-9-20(19)16-22/h1-13,16-17H,14-15H2