2-carboxy-2-phenyl-N-propyl-butanenitrilium

Systemtic Name: 2-carboxy-2-phenyl-N-propyl-butanenitrilium Openeye Name: 2-carboxy-2-phenyl-N-propyl-butanenitrilium CAS Name: 2-carboxy-2-phenyl-N-propylbutanenitrilium IUPAC Name: 2-carboxy-2-phenyl-N-propylbutanenitrilium Traditional Name: 2-carboxy-2-phenyl-N-propyl-butyronitrilium Formula: C14H18NO2+ MolecularWeight: 232.29822

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]#CC(CC)(C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCC[N+]#CC(CC)(C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H17NO2/c1-3-10-15-11-14(4-2,13(16)17)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3/p+1