butyl 4-(4-imidazol-1-ylphenyl)sulfonylbenzoate

Systemtic Name: butyl 4-(4-imidazol-1-ylphenyl)sulfonylbenzoate Openeye Name: butyl 4-(4-imidazol-1-ylphenyl)sulfonylbenzoate CAS Name: 4-[4-(1-imidazolyl)phenyl]sulfonylbenzoic acid butyl ester IUPAC Name: butyl 4-(4-imidazol-1-ylphenyl)sulfonylbenzoate Traditional Name: 4-(4-imidazol-1-ylphenyl)sulfonylbenzoic acid butyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C20H20N2O4S/c1-2-3-14-26-20(23)16-4-8-18(9-5-16)27(24,25)19-10-6-17(7-11-19)22-13-12-21-15-22/h4-13,15H,2-3,14H2,1H3