1-imidazol-1-yl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecan-1-one

Systemtic Name: 1-imidazol-1-yl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecan-1-one Openeye Name: 2-[4-(4-benzyloxyphenyl)sulfonylphenoxy]-1-imidazol-1-yl-dodecan-1-one CAS Name: 1-(1-imidazolyl)-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]-1-dodecanone IUPAC Name: 1-imidazol-1-yl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecan-1-one Traditional Name: 2-[4-(4-benzoxyphenyl)sulfonylphenoxy]-1-imidazol-1-yl-dodecan-1-one Formula: C34H40N2O5S MolecularWeight: 588.7568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)N1C=CN=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCC(C(=O)N1C=CN=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C34H40N2O5S/c1-2-3-4-5-6-7-8-12-15-33(34(37)36-25-24-35-27-36)41-30-18-22-32(23-19-30)42(38,39)31-20-16-29(17-21-31)40-26-28-13-10-9-11-14-28/h9-11,13-14,16-25,27,33H,2-8,12,15,26H2,1H3