[(2R)-4-(dimethylamino)-4-oxidanylidene-butan-2-yl]-[(4-morpholin-4-ylsulfonylphenyl)methyl]azanium

Systemtic Name: [(2R)-4-(dimethylamino)-4-oxidanylidene-butan-2-yl]-[(4-morpholin-4-ylsulfonylphenyl)methyl]azanium Openeye Name: [(1R)-3-(dimethylamino)-1-methyl-3-oxo-propyl]-[(4-morpholinosulfonylphenyl)methyl]ammonium CAS Name: [(2R)-4-(dimethylamino)-4-oxobutan-2-yl]-[[4-(4-morpholinylsulfonyl)phenyl]methyl]ammonium IUPAC Name: [(2R)-4-(dimethylamino)-4-oxobutan-2-yl]-[(4-morpholin-4-ylsulfonylphenyl)methyl]azanium Traditional Name: [(1R)-3-(dimethylamino)-3-keto-1-methyl-propyl]-(4-morpholinosulfonylbenzyl)ammonium Formula: C17H28N3O4S+ MolecularWeight: 370.48692

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N(C)C)[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

C[C@H](CC(=O)N(C)C)[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H27N3O4S/c1-14(12-17(21)19(2)3)18-13-15-4-6-16(7-5-15)25(22,23)20-8-10-24-11-9-20/h4-7,14,18H,8-13H2,1-3H3/p+1/t14-/m1/s1