[5-(diethylamino)-2-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate

Systemtic Name: [5-(diethylamino)-2-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate Openeye Name: [5-(diethylamino)-2-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-(diethylamino)-2-[(2-dimethylaminoethylamino)methyl]phenyl] ester IUPAC Name: [5-(diethylamino)-2-[(2-dimethylaminoethylamino)methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-(diethylamino)-2-[(2-dimethylaminoethylamino)methyl]phenyl] ester Formula: C17H31N3O3S MolecularWeight: 357.51134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)CNCCN(C)C)OS(=O)(=O)CC

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)CNCCN(C)C)OS(=O)(=O)CC

InChI

InChI=1S/C17H31N3O3S/c1-6-20(7-2)16-10-9-15(14-18-11-12-19(4)5)17(13-16)23-24(21,22)8-3/h9-10,13,18H,6-8,11-12,14H2,1-5H3