[(2R)-2-cyanopropyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: [(2R)-2-cyanopropyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: [(2R)-2-cyanopropyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: [(2R)-2-cyanopropyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: [(2R)-2-cyanopropyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: [(2R)-2-cyanopropyl]-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](C)CC1=CC=C(C=C1)C(=O)NC)C#N

Isomeric SMILES

C[C@H](C[NH+](C)CC1=CC=C(C=C1)C(=O)NC)C#N

InChI

InChI=1S/C14H19N3O/c1-11(8-15)9-17(3)10-12-4-6-13(7-5-12)14(18)16-2/h4-7,11H,9-10H2,1-3H3,(H,16,18)/p+1/t11-/m0/s1