1-[5-[(4-cyanophenyl)methyl]imidazol-1-yl]ethyl methanesulfonate

Systemtic Name: 1-[5-[(4-cyanophenyl)methyl]imidazol-1-yl]ethyl methanesulfonate Openeye Name: 1-[5-[(4-cyanophenyl)methyl]imidazol-1-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 1-[5-[(4-cyanophenyl)methyl]-1-imidazolyl]ethyl ester IUPAC Name: 1-[5-[(4-cyanophenyl)methyl]imidazol-1-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 1-[5-(4-cyanobenzyl)imidazol-1-yl]ethyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(N1C=NC=C1CC2=CC=C(C=C2)C#N)OS(=O)(=O)C

Isomeric SMILES

CC(N1C=NC=C1CC2=CC=C(C=C2)C#N)OS(=O)(=O)C

InChI

InChI=1S/C14H15N3O3S/c1-11(20-21(2,18)19)17-10-16-9-14(17)7-12-3-5-13(8-15)6-4-12/h3-6,9-11H,7H2,1-2H3