[4-[(4-azanyl-2-chloranyl-phenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium

Systemtic Name: [4-[(4-azanyl-2-chloranyl-phenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium Openeye Name: [4-(4-amino-2-chloro-anilino)-4-oxo-butyl]-dimethyl-ammonium CAS Name: [4-(4-amino-2-chloroanilino)-4-oxobutyl]-dimethylammonium IUPAC Name: [4-(4-amino-2-chloroanilino)-4-oxobutyl]-dimethylazanium Traditional Name: [4-(4-amino-2-chloro-anilino)-4-keto-butyl]-dimethyl-ammonium Formula: C12H19ClN3O+ MolecularWeight: 256.75176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18ClN3O/c1-16(2)7-3-4-12(17)15-11-6-5-9(14)8-10(11)13/h5-6,8H,3-4,7,14H2,1-2H3,(H,15,17)/p+1