naphthalen-1-yl 3-bromanyl-4-phenethyloxy-benzoate

Systemtic Name: naphthalen-1-yl 3-bromanyl-4-phenethyloxy-benzoate Openeye Name: 1-naphthyl 3-bromo-4-phenethyloxy-benzoate CAS Name: 3-bromo-4-phenethyloxybenzoic acid 1-naphthalenyl ester IUPAC Name: naphthalen-1-yl 3-bromo-4-phenethyloxybenzoate Traditional Name: 3-bromo-4-phenethyloxy-benzoic acid 1-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=CC=CC4=CC=CC=C43)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)OC3=CC=CC4=CC=CC=C43)Br

InChI

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