[(2R)-1-[(3-azanyl-4-chloranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-methyl-azanium

Systemtic Name: [(2R)-1-[(3-azanyl-4-chloranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-butyl-methyl-azanium Openeye Name: [(1R)-2-(3-amino-4-chloro-anilino)-1-methyl-2-oxo-ethyl]-butyl-methyl-ammonium CAS Name: [(2R)-1-(3-amino-4-chloroanilino)-1-oxopropan-2-yl]-butyl-methylammonium IUPAC Name: [(2R)-1-(3-amino-4-chloroanilino)-1-oxopropan-2-yl]-butyl-methylazanium Traditional Name: [(1R)-2-(3-amino-4-chloro-anilino)-2-keto-1-methyl-ethyl]-butyl-methyl-ammonium Formula: C14H23ClN3O+ MolecularWeight: 284.80492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C)C(=O)NC1=CC(=C(C=C1)Cl)N

Isomeric SMILES

CCCC[NH+](C)[C@H](C)C(=O)NC1=CC(=C(C=C1)Cl)N

InChI

InChI=1S/C14H22ClN3O/c1-4-5-8-18(3)10(2)14(19)17-11-6-7-12(15)13(16)9-11/h6-7,9-10H,4-5,8,16H2,1-3H3,(H,17,19)/p+1/t10-/m1/s1