[2-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ethanesulfonate

Systemtic Name: [2-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ethanesulfonate Openeye Name: [2-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ester IUPAC Name: [2-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [2-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ester Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CC1=C(C=C(C=C1)N(CC)CC)OS(=O)(=O)CC)C2CC2

Isomeric SMILES

CCNC(=O)N(CC1=C(C=C(C=C1)N(CC)CC)OS(=O)(=O)CC)C2CC2

InChI

InChI=1S/C19H31N3O4S/c1-5-20-19(23)22(16-11-12-16)14-15-9-10-17(21(6-2)7-3)13-18(15)26-27(24,25)8-4/h9-10,13,16H,5-8,11-12,14H2,1-4H3,(H,20,23)