(2,3-dibutoxy-6-chloranyl-4-propoxy-naphthalen-1-yl) 3,5-bis(chloranyl)benzoate

Systemtic Name: (2,3-dibutoxy-6-chloranyl-4-propoxy-naphthalen-1-yl) 3,5-bis(chloranyl)benzoate Openeye Name: (2,3-dibutoxy-6-chloro-4-propoxy-1-naphthyl) 3,5-dichlorobenzoate CAS Name: 3,5-dichlorobenzoic acid (2,3-dibutoxy-6-chloro-4-propoxy-1-naphthalenyl) ester IUPAC Name: (2,3-dibutoxy-6-chloro-4-propoxynaphthalen-1-yl) 3,5-dichlorobenzoate Traditional Name: 3,5-dichlorobenzoic acid (2,3-dibutoxy-6-chloro-4-propoxy-1-naphthyl) ester Formula: C28H31Cl3O5 MolecularWeight: 553.90174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=C(C=C(C=C2)Cl)C(=C1OCCCC)OCCC)OC(=O)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CCCCOC1=C(C2=C(C=C(C=C2)Cl)C(=C1OCCCC)OCCC)OC(=O)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C28H31Cl3O5/c1-4-7-12-34-26-24(33-11-6-3)23-17-19(29)9-10-22(23)25(27(26)35-13-8-5-2)36-28(32)18-14-20(30)16-21(31)15-18/h9-10,14-17H,4-8,11-13H2,1-3H3