[3-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate

Systemtic Name: [3-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate Openeye Name: [3-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [3-[(2-dimethylaminoethylamino)methyl]phenyl] ester IUPAC Name: [3-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [3-[(2-dimethylaminoethylamino)methyl]phenyl] ester Formula: C13H22N2O3S MolecularWeight: 286.39038

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=CC(=C1)CNCCN(C)C

Isomeric SMILES

CCS(=O)(=O)OC1=CC=CC(=C1)CNCCN(C)C

InChI

InChI=1S/C13H22N2O3S/c1-4-19(16,17)18-13-7-5-6-12(10-13)11-14-8-9-15(2)3/h5-7,10,14H,4,8-9,11H2,1-3H3