[4-[(3-azanyl-4-chloranyl-phenyl)amino]-4-oxidanylidene-butyl]-butyl-ethyl-azanium

Systemtic Name: [4-[(3-azanyl-4-chloranyl-phenyl)amino]-4-oxidanylidene-butyl]-butyl-ethyl-azanium Openeye Name: [4-(3-amino-4-chloro-anilino)-4-oxo-butyl]-butyl-ethyl-ammonium CAS Name: [4-(3-amino-4-chloroanilino)-4-oxobutyl]-butyl-ethylammonium IUPAC Name: [4-(3-amino-4-chloroanilino)-4-oxobutyl]-butyl-ethylazanium Traditional Name: [4-(3-amino-4-chloro-anilino)-4-keto-butyl]-butyl-ethyl-ammonium Formula: C16H27ClN3O+ MolecularWeight: 312.85808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26ClN3O/c1-3-5-10-20(4-2)11-6-7-16(21)19-13-8-9-14(17)15(18)12-13/h8-9,12H,3-7,10-11,18H2,1-2H3,(H,19,21)/p+1