[(3S)-2-[(phenylmethyl)carbamoyl]pent-1-en-3-yl] methanesulfonate

Systemtic Name: [(3S)-2-[(phenylmethyl)carbamoyl]pent-1-en-3-yl] methanesulfonate Openeye Name: [(1S)-2-(benzylcarbamoyl)-1-ethyl-allyl] methanesulfonate CAS Name: methanesulfonic acid [(3S)-2-[oxo-[(phenylmethyl)amino]methyl]pent-1-en-3-yl] ester IUPAC Name: [(3S)-2-(benzylcarbamoyl)pent-1-en-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1S)-2-(benzylcarbamoyl)-1-ethyl-allyl] ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=C)C(=O)NCC1=CC=CC=C1)OS(=O)(=O)C

Isomeric SMILES

CC[C@@H](C(=C)C(=O)NCC1=CC=CC=C1)OS(=O)(=O)C

InChI

InChI=1S/C14H19NO4S/c1-4-13(19-20(3,17)18)11(2)14(16)15-10-12-8-6-5-7-9-12/h5-9,13H,2,4,10H2,1,3H3,(H,15,16)/t13-/m0/s1