chromeno[4,3-c]pyrazol-3-yl-[1-(6-methoxy-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]methanone

Systemtic Name: chromeno[4,3-c]pyrazol-3-yl-[1-(6-methoxy-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]methanone Openeye Name: chromeno[4,3-c]pyrazol-3-yl-[1-(6-methoxy-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]methanone CAS Name: 3-[1]benzopyrano[4,3-c]pyrazolyl-[1-(6-methoxy-1,4-dihydropyridin-3-yl)-4-methyl-1-piperazin-1-iumyl]methanone IUPAC Name: chromeno[4,3-c]pyrazol-3-yl-[1-(6-methoxy-1,4-dihydropyridin-3-yl)-4-methylpiperazin-1-ium-1-yl]methanone Traditional Name: chromeno[4,3-c]pyrazol-3-yl-[1-(6-methoxy-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]methanone Formula: C22H24N5O3+ MolecularWeight: 406.45766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](CC1)(C2=CNC(=CC2)OC)C(=O)C3=NN=C4C3=COC5=CC=CC=C54

Isomeric SMILES

CN1CC[N+](CC1)(C2=CNC(=CC2)OC)C(=O)C3=NN=C4C3=COC5=CC=CC=C54

InChI

InChI=1S/C22H24N5O3/c1-26-9-11-27(12-10-26,15-7-8-19(29-2)23-13-15)22(28)21-17-14-30-18-6-4-3-5-16(18)20(17)24-25-21/h3-6,8,13-14,23H,7,9-12H2,1-2H3/q+1