1-[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(4-cyanoanilino)-3-oxo-propyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(4-cyanoanilino)-3-oxopropyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(4-cyanoanilino)-3-oxopropyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(4-cyanoanilino)-3-keto-propyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C22H25N4O2+ MolecularWeight: 377.4595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H24N4O2/c23-16-17-6-8-20(9-7-17)24-21(27)12-15-26-13-10-18(11-14-26)22(28)25-19-4-2-1-3-5-19/h1-9,18H,10-15H2,(H,24,27)(H,25,28)/p+1