2-(2-methylprop-2-enylamino)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(2-methylprop-2-enylamino)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(2-methylallylamino)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(2-methylprop-2-enylamino)ethyl ester IUPAC Name: 2-(2-methylprop-2-enylamino)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(2-methylallylamino)ethyl ester Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCNCC(=C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCNCC(=C)C

InChI

InChI=1S/C13H19NO3S/c1-11(2)10-14-8-9-17-18(15,16)13-6-4-12(3)5-7-13/h4-7,14H,1,8-10H2,2-3H3