[5-imidazol-1-yl-1-(4-methoxyphenyl)pentan-2-yl] methanesulfonate

Systemtic Name: [5-imidazol-1-yl-1-(4-methoxyphenyl)pentan-2-yl] methanesulfonate Openeye Name: [4-imidazol-1-yl-1-[(4-methoxyphenyl)methyl]butyl] methanesulfonate CAS Name: methanesulfonic acid [5-(1-imidazolyl)-1-(4-methoxyphenyl)pentan-2-yl] ester IUPAC Name: [5-imidazol-1-yl-1-(4-methoxyphenyl)pentan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid (4-imidazol-1-yl-1-p-anisyl-butyl) ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(CCCN2C=CN=C2)OS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CC(CCCN2C=CN=C2)OS(=O)(=O)C

InChI

InChI=1S/C16H22N2O4S/c1-21-15-7-5-14(6-8-15)12-16(22-23(2,19)20)4-3-10-18-11-9-17-13-18/h5-9,11,13,16H,3-4,10,12H2,1-2H3