3-(N-phenyl-C-piperidin-1-yl-carbonimidoyl)sulfanylpropanoate

Systemtic Name: 3-(N-phenyl-C-piperidin-1-yl-carbonimidoyl)sulfanylpropanoate Openeye Name: 3-[N-phenyl-C-(1-piperidyl)carbonimidoyl]sulfanylpropanoate CAS Name: 3-[[phenylimino(1-piperidinyl)methyl]thio]propanoate IUPAC Name: 3-(N-phenyl-C-piperidin-1-ylcarbonimidoyl)sulfanylpropanoate Traditional Name: 3-[(N-phenyl-C-piperidino-carbonimidoyl)thio]propionate Formula: C15H19N2O2S- MolecularWeight: 291.38856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=NC2=CC=CC=C2)SCCC(=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=NC2=CC=CC=C2)SCCC(=O)[O-]

InChI

InChI=1S/C15H20N2O2S/c18-14(19)9-12-20-15(17-10-5-2-6-11-17)16-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2,(H,18,19)/p-1