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

Systemtic Name: [2-[[cyclopropyl(propan-2-ylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate Openeye Name: [2-[[cyclopropyl(isopropylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-[[cyclopropyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]-5-(diethylamino)phenyl] ester IUPAC Name: [2-[[cyclopropyl(propan-2-ylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[[cyclopropyl(isopropylcarbamoyl)amino]methyl]-5-(diethylamino)phenyl] ester Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31N3O4S/c1-6-21(7-2)17-9-8-15(18(12-17)26-27(5,24)25)13-22(16-10-11-16)19(23)20-14(3)4/h8-9,12,14,16H,6-7,10-11,13H2,1-5H3,(H,20,23)