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

Systemtic Name: [5-[[cyclopropyl(propan-2-ylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[cyclopropyl(isopropylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[cyclopropyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[cyclopropyl(propan-2-ylcarbamoyl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[cyclopropyl(isopropylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C2CC2)C(=O)NC(C)C)OC

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C2CC2)C(=O)NC(C)C)OC

InChI

InChI=1S/C17H26N2O5S/c1-5-25(21,22)24-16-10-13(6-9-15(16)23-4)11-19(14-7-8-14)17(20)18-12(2)3/h6,9-10,12,14H,5,7-8,11H2,1-4H3,(H,18,20)