phenyl 2-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-amino]ethanesulfonate

Systemtic Name: phenyl 2-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-amino]ethanesulfonate Openeye Name: phenyl 2-[[2-(cyclopropylamino)-2-oxo-ethyl]-methyl-amino]ethanesulfonate CAS Name: 2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]ethanesulfonate Traditional Name: 2-[[2-(cyclopropylamino)-2-keto-ethyl]-methyl-amino]ethanesulfonic acid phenyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCS(=O)(=O)OC1=CC=CC=C1)CC(=O)NC2CC2

Isomeric SMILES

CN(CCS(=O)(=O)OC1=CC=CC=C1)CC(=O)NC2CC2

InChI

InChI=1S/C14H20N2O4S/c1-16(11-14(17)15-12-7-8-12)9-10-21(18,19)20-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H,15,17)