butyl-[(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: butyl-[(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: butyl-[(1R)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: butyl-[(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: butyl-[(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl]-methylazanium Traditional Name: butyl-[(1R)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C)C(=O)NC1=CC=CC=C1C#N

Isomeric SMILES

CCCC[NH+](C)[C@H](C)C(=O)NC1=CC=CC=C1C#N

InChI

InChI=1S/C15H21N3O/c1-4-5-10-18(3)12(2)15(19)17-14-9-7-6-8-13(14)11-16/h6-9,12H,4-5,10H2,1-3H3,(H,17,19)/p+1/t12-/m1/s1