4-chloranyl-N-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-chloro-N-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 4-chloro-N-[3-oxo-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 4-chloro-N-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 4-chloro-N-[3-keto-3-(4-pyridin-1-ium-2-ylpiperazino)propyl]benzamide Formula: C19H22ClN4O2+ MolecularWeight: 373.85658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN4O2/c20-16-6-4-15(5-7-16)19(26)22-10-8-18(25)24-13-11-23(12-14-24)17-3-1-2-9-21-17/h1-7,9H,8,10-14H2,(H,22,26)/p+1