[4-[[3,3-dimethylbutanoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-[[3,3-dimethylbutanoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-[[3,3-dimethylbutanoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[[(3,3-dimethyl-1-oxobutyl)-(2-methoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[3,3-dimethylbutanoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[[3,3-dimethylbutanoyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C18H29NO5S MolecularWeight: 371.49156

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=C(C=C1)CN(CCOC)C(=O)CC(C)(C)C

Isomeric SMILES

CCS(=O)(=O)OC1=CC=C(C=C1)CN(CCOC)C(=O)CC(C)(C)C

InChI

InChI=1S/C18H29NO5S/c1-6-25(21,22)24-16-9-7-15(8-10-16)14-19(11-12-23-5)17(20)13-18(2,3)4/h7-10H,6,11-14H2,1-5H3