2-(2-methylpropanoylamino)ethyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: 2-(2-methylpropanoylamino)ethyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: 2-(2-methylpropanoylamino)ethyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: 2-[(2-methyl-1-oxopropyl)amino]ethyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: 2-(2-methylpropanoylamino)ethyl-[(1R)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: 2-(isobutyrylamino)ethyl-[(1R)-1-(4-mesylphenyl)ethyl]ammonium Formula: C15H25N2O3S+ MolecularWeight: 313.4356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC[NH2+]C(C)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)S(=O)(=O)C)[NH2+]CCNC(=O)C(C)C

InChI

InChI=1S/C15H24N2O3S/c1-11(2)15(18)17-10-9-16-12(3)13-5-7-14(8-6-13)21(4,19)20/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18)/p+1/t12-/m1/s1