[4-cyano-4-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butyl] benzoate

Systemtic Name: [4-cyano-4-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butyl] benzoate Openeye Name: [4-cyano-4-(3,4-dichlorophenyl)-4-tetrahydropyran-2-yloxy-butyl] benzoate CAS Name: benzoic acid [4-cyano-4-(3,4-dichlorophenyl)-4-(2-oxanyloxy)butyl] ester IUPAC Name: [4-cyano-4-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butyl] benzoate Traditional Name: benzoic acid [4-cyano-4-(3,4-dichlorophenyl)-4-tetrahydropyran-2-yloxy-butyl] ester Formula: C23H23Cl2NO4 MolecularWeight: 448.33902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC(CCCOC(=O)C2=CC=CC=C2)(C#N)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCOC(C1)OC(CCCOC(=O)C2=CC=CC=C2)(C#N)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H23Cl2NO4/c24-19-11-10-18(15-20(19)25)23(16-26,30-21-9-4-5-13-28-21)12-6-14-29-22(27)17-7-2-1-3-8-17/h1-3,7-8,10-11,15,21H,4-6,9,12-14H2