N-[2-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide

Systemtic Name: N-[2-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide Openeye Name: N-[2-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[2-[4-[(4-cyanophenyl)methyl]-1-piperazin-4-iumyl]-2-oxoethyl]-2-furancarboxamide IUPAC Name: N-[2-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-2-oxoethyl]furan-2-carboxamide Traditional Name: N-[2-[4-(4-cyanobenzyl)piperazin-4-ium-1-yl]-2-keto-ethyl]-2-furamide Formula: C19H21N4O3+ MolecularWeight: 353.39504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C#N)C(=O)CNC(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C#N)C(=O)CNC(=O)C3=CC=CO3

InChI

InChI=1S/C19H20N4O3/c20-12-15-3-5-16(6-4-15)14-22-7-9-23(10-8-22)18(24)13-21-19(25)17-2-1-11-26-17/h1-6,11H,7-10,13-14H2,(H,21,25)/p+1