2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl-prop-2-ynyl-azanium

Systemtic Name: 2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl-prop-2-ynyl-azanium Openeye Name: 2-(2-chloro-4-nitro-anilino)ethyl-prop-2-ynyl-ammonium CAS Name: 2-(2-chloro-4-nitroanilino)ethyl-prop-2-ynylammonium IUPAC Name: 2-(2-chloro-4-nitroanilino)ethyl-prop-2-ynylazanium Traditional Name: 2-(2-chloro-4-nitro-anilino)ethyl-propargyl-ammonium Formula: C11H13ClN3O2+ MolecularWeight: 254.69282

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH2+]CCNC1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

C#CC[NH2+]CCNC1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H12ClN3O2/c1-2-5-13-6-7-14-11-4-3-9(15(16)17)8-10(11)12/h1,3-4,8,13-14H,5-7H2/p+1