[4-(1-iodanylhexoxy)-2,3-dimethoxy-naphthalen-1-yl] benzoate

Systemtic Name: [4-(1-iodanylhexoxy)-2,3-dimethoxy-naphthalen-1-yl] benzoate Openeye Name: [4-(1-iodohexoxy)-2,3-dimethoxy-1-naphthyl] benzoate CAS Name: benzoic acid [4-(1-iodohexoxy)-2,3-dimethoxy-1-naphthalenyl] ester IUPAC Name: [4-(1-iodohexoxy)-2,3-dimethoxynaphthalen-1-yl] benzoate Traditional Name: benzoic acid [4-(1-iodohexoxy)-2,3-dimethoxy-1-naphthyl] ester Formula: C25H27IO5 MolecularWeight: 534.38335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(OC1=C(C(=C(C2=CC=CC=C21)OC(=O)C3=CC=CC=C3)OC)OC)I

Isomeric SMILES

CCCCCC(OC1=C(C(=C(C2=CC=CC=C21)OC(=O)C3=CC=CC=C3)OC)OC)I

InChI

InChI=1S/C25H27IO5/c1-4-5-7-16-20(26)30-21-18-14-10-11-15-19(18)22(24(29-3)23(21)28-2)31-25(27)17-12-8-6-9-13-17/h6,8-15,20H,4-5,7,16H2,1-3H3