3-(4-phenylpiperazin-1-ium-1-yl)-N-[(Z)-pyridin-4-ylmethylideneamino]propanamide

Systemtic Name: 3-(4-phenylpiperazin-1-ium-1-yl)-N-[(Z)-pyridin-4-ylmethylideneamino]propanamide Openeye Name: 3-(4-phenylpiperazin-1-ium-1-yl)-N-[(Z)-4-pyridylmethyleneamino]propanamide CAS Name: 3-(4-phenyl-1-piperazin-1-iumyl)-N-[(Z)-pyridin-4-ylmethylideneamino]propanamide IUPAC Name: 3-(4-phenylpiperazin-1-ium-1-yl)-N-[(Z)-pyridin-4-ylmethylideneamino]propanamide Traditional Name: 3-(4-phenylpiperazin-1-ium-1-yl)-N-[(Z)-4-pyridylmethyleneamino]propionamide Formula: C19H24N5O+ MolecularWeight: 338.42676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NN=CC2=CC=NC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)N/N=C\C2=CC=NC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N5O/c25-19(22-21-16-17-6-9-20-10-7-17)8-11-23-12-14-24(15-13-23)18-4-2-1-3-5-18/h1-7,9-10,16H,8,11-15H2,(H,22,25)/p+1/b21-16-