3-[[(S)-cyano-(2,4-dichlorophenyl)methyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(S)-cyano-(2,4-dichlorophenyl)methyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(S)-cyano-(2,4-dichlorophenyl)methyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(S)-cyano-(2,4-dichlorophenyl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(S)-cyano-(2,4-dichlorophenyl)methyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(S)-cyano-(2,4-dichlorophenyl)methyl]amino]propyl-dimethyl-ammonium Formula: C13H18Cl2N3+ MolecularWeight: 287.20812

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(C#N)C1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

C[NH+](C)CCCN[C@H](C#N)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C13H17Cl2N3/c1-18(2)7-3-6-17-13(9-16)11-5-4-10(14)8-12(11)15/h4-5,8,13,17H,3,6-7H2,1-2H3/p+1/t13-/m1/s1