[(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-dipropyl-azanium

Systemtic Name: [(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-dipropyl-azanium Openeye Name: [(1R)-2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl]-dipropyl-ammonium CAS Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-dipropylammonium IUPAC Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-dipropylazanium Traditional Name: [(1R)-2-(4-cyanoanilino)-2-keto-1-methyl-ethyl]-dipropyl-ammonium Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)C(C)C(=O)NC1=CC=C(C=C1)C#N

Isomeric SMILES

CCC[NH+](CCC)[C@H](C)C(=O)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C16H23N3O/c1-4-10-19(11-5-2)13(3)16(20)18-15-8-6-14(12-17)7-9-15/h6-9,13H,4-5,10-11H2,1-3H3,(H,18,20)/p+1/t13-/m1/s1