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

Systemtic Name: [5-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[cyclopropyl(ethylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C16H24N2O5S MolecularWeight: 356.43716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O5S/c1-4-17-16(19)18(13-7-8-13)11-12-6-9-14(22-3)15(10-12)23-24(20,21)5-2/h6,9-10,13H,4-5,7-8,11H2,1-3H3,(H,17,19)