N-(2-azanyl-4-chloranyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(2-azanyl-4-chloranyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-amino-4-chloro-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-(2-amino-4-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(2-amino-4-chlorophenyl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(2-amino-4-chloro-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C12H17ClN3O+ MolecularWeight: 254.73588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=C(C=C(C=C2)Cl)N

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=C(C=C(C=C2)Cl)N

InChI

InChI=1S/C12H16ClN3O/c13-9-3-4-11(10(14)7-9)15-12(17)8-16-5-1-2-6-16/h3-4,7H,1-2,5-6,8,14H2,(H,15,17)/p+1