4-(3-cyanopyridin-1-ium-2-yl)-N-naphthalen-1-yl-piperazine-1-carboxamide

Systemtic Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-naphthalen-1-yl-piperazine-1-carboxamide Openeye Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-(1-naphthyl)piperazine-1-carboxamide CAS Name: 4-(3-cyano-2-pyridin-1-iumyl)-N-(1-naphthalenyl)-1-piperazinecarboxamide IUPAC Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-naphthalen-1-ylpiperazine-1-carboxamide Traditional Name: 4-(3-cyanopyridin-1-ium-2-yl)-N-(1-naphthyl)piperazine-1-carboxamide Formula: C21H20N5O+ MolecularWeight: 358.4164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)C#N)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)C#N)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H19N5O/c22-15-17-7-4-10-23-20(17)25-11-13-26(14-12-25)21(27)24-19-9-3-6-16-5-1-2-8-18(16)19/h1-10H,11-14H2,(H,24,27)/p+1