2-[(4-chloranyl-2-cyano-phenyl)carbamoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-chloranyl-2-cyano-phenyl)carbamoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-chloro-2-cyano-phenyl)carbamoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(4-chloro-2-cyanoanilino)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-chloro-2-cyanophenyl)carbamoylamino]ethyl-dimethylazanium Traditional Name: 2-[(4-chloro-2-cyano-phenyl)carbamoylamino]ethyl-dimethyl-ammonium Formula: C12H16ClN4O+ MolecularWeight: 267.73464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN4O/c1-17(2)6-5-15-12(18)16-11-4-3-10(13)7-9(11)8-14/h3-4,7H,5-6H2,1-2H3,(H2,15,16,18)/p+1