[2-[[cyclopropyl(2-methylpropanoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate

Systemtic Name: [2-[[cyclopropyl(2-methylpropanoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate Openeye Name: [2-[[cyclopropyl(2-methylpropanoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-[[cyclopropyl-(2-methyl-1-oxopropyl)amino]methyl]-5-(diethylamino)phenyl] ester IUPAC Name: [2-[[cyclopropyl(2-methylpropanoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[[cyclopropyl(isobutyryl)amino]methyl]-5-(diethylamino)phenyl] ester Formula: C19H30N2O4S MolecularWeight: 382.5175

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)CN(C2CC2)C(=O)C(C)C)OS(=O)(=O)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)CN(C2CC2)C(=O)C(C)C)OS(=O)(=O)C

InChI

InChI=1S/C19H30N2O4S/c1-6-20(7-2)17-9-8-15(18(12-17)25-26(5,23)24)13-21(16-10-11-16)19(22)14(3)4/h8-9,12,14,16H,6-7,10-11,13H2,1-5H3