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

Systemtic Name: [2-[[cyclopropyl(propan-2-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [2-[[cyclopropyl(isopropylcarbamoyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-[[cyclopropyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]phenyl] ester IUPAC Name: [2-[[cyclopropyl(propan-2-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [2-[[cyclopropyl(isopropylcarbamoyl)amino]methyl]phenyl] ester Formula: C16H24N2O4S MolecularWeight: 340.43776

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=CC=C1CN(C2CC2)C(=O)NC(C)C

Isomeric SMILES

CCS(=O)(=O)OC1=CC=CC=C1CN(C2CC2)C(=O)NC(C)C

InChI

InChI=1S/C16H24N2O4S/c1-4-23(20,21)22-15-8-6-5-7-13(15)11-18(14-9-10-14)16(19)17-12(2)3/h5-8,12,14H,4,9-11H2,1-3H3,(H,17,19)