[1-cyano-4-(3-phenylphenyl)butan-2-yl] methanesulfonate

Systemtic Name: [1-cyano-4-(3-phenylphenyl)butan-2-yl] methanesulfonate Openeye Name: [1-(cyanomethyl)-3-(3-phenylphenyl)propyl] methanesulfonate CAS Name: methanesulfonic acid [1-cyano-4-(3-phenylphenyl)butan-2-yl] ester IUPAC Name: [1-cyano-4-(3-phenylphenyl)butan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-(cyanomethyl)-3-(3-phenylphenyl)propyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CCC1=CC=CC(=C1)C2=CC=CC=C2)CC#N

Isomeric SMILES

CS(=O)(=O)OC(CCC1=CC=CC(=C1)C2=CC=CC=C2)CC#N

InChI

InChI=1S/C18H19NO3S/c1-23(20,21)22-18(12-13-19)11-10-15-6-5-9-17(14-15)16-7-3-2-4-8-16/h2-9,14,18H,10-12H2,1H3