5-(8-methoxy-2H-chromen-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole

Systemtic Name: 5-(8-methoxy-2H-chromen-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole Openeye Name: 5-(8-methoxy-2H-chromen-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole CAS Name: 5-(8-methoxy-2H-1-benzopyran-3-yl)-1-(1-methyl-4-piperidin-1-iumyl)-2H-imidazo[4,5-c]pyrazole IUPAC Name: 5-(8-methoxy-2H-chromen-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole Traditional Name: 5-(8-methoxy-2H-chromen-3-yl)-1-(1-methylpiperidin-1-ium-4-yl)-2H-imidazo[4,5-c]pyrazole Formula: C20H24N5O2+ MolecularWeight: 366.43686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2C3=NC(=NC3=CN2)C4=CC5=C(C(=CC=C5)OC)OC4

Isomeric SMILES

C[NH+]1CCC(CC1)N2C3=NC(=NC3=CN2)C4=CC5=C(C(=CC=C5)OC)OC4

InChI

InChI=1S/C20H23N5O2/c1-24-8-6-15(7-9-24)25-20-16(11-21-25)22-19(23-20)14-10-13-4-3-5-17(26-2)18(13)27-12-14/h3-5,10-11,15,21H,6-9,12H2,1-2H3/p+1