methyl 4-methylsulfonyl-2-[1-(phenylmethoxymethyl)imidazol-4-yl]butanoate

Systemtic Name: methyl 4-methylsulfonyl-2-[1-(phenylmethoxymethyl)imidazol-4-yl]butanoate Openeye Name: methyl 2-[1-(benzyloxymethyl)imidazol-4-yl]-4-methylsulfonyl-butanoate CAS Name: 4-methylsulfonyl-2-[1-(phenylmethoxymethyl)-4-imidazolyl]butanoic acid methyl ester IUPAC Name: methyl 4-methylsulfonyl-2-[1-(phenylmethoxymethyl)imidazol-4-yl]butanoate Traditional Name: 2-[1-(benzoxymethyl)imidazol-4-yl]-4-mesyl-butyric acid methyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCS(=O)(=O)C)C1=CN(C=N1)COCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CCS(=O)(=O)C)C1=CN(C=N1)COCC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O5S/c1-23-17(20)15(8-9-25(2,21)22)16-10-19(12-18-16)13-24-11-14-6-4-3-5-7-14/h3-7,10,12,15H,8-9,11,13H2,1-2H3