[methyl-[(E)-4-phenylbut-3-enoyl]amino] methanesulfonate

Systemtic Name: [methyl-[(E)-4-phenylbut-3-enoyl]amino] methanesulfonate Openeye Name: [methyl-[(E)-4-phenylbut-3-enoyl]amino] methanesulfonate CAS Name: methanesulfonic acid [methyl-[(E)-1-oxo-4-phenylbut-3-enyl]amino] ester IUPAC Name: [methyl-[(E)-4-phenylbut-3-enoyl]amino] methanesulfonate Traditional Name: methanesulfonic acid [methyl-[(E)-4-phenylbut-3-enoyl]amino] ester Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CC=CC1=CC=CC=C1)OS(=O)(=O)C

Isomeric SMILES

CN(C(=O)C/C=C/C1=CC=CC=C1)OS(=O)(=O)C

InChI

InChI=1S/C12H15NO4S/c1-13(17-18(2,15)16)12(14)10-6-9-11-7-4-3-5-8-11/h3-9H,10H2,1-2H3/b9-6+