N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]furan-3-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]furan-3-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]furan-3-carboxamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-3-furancarboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]furan-3-carboxamide Traditional Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-3-furamide Formula: C18H24N3O2+ MolecularWeight: 314.40206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3=COC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)C3=COC=C3

InChI

InChI=1S/C18H23N3O2/c1-15-3-2-4-17(13-15)21-10-8-20(9-11-21)7-6-19-18(22)16-5-12-23-14-16/h2-5,12-14H,6-11H2,1H3,(H,19,22)/p+1