1-[1-(phenylmethyl)piperidin-1-ium-4-yl]chromeno[3,4-d]imidazol-4-one

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]chromeno[3,4-d]imidazol-4-one Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)chromeno[3,4-d]imidazol-4-one CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-[1]benzopyrano[3,4-d]imidazolone IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)chromeno[3,4-d]imidazol-4-one Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)chromen[3,4-d]imidazol-4-one Formula: C22H22N3O2+ MolecularWeight: 360.42898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=NC3=C2C4=CC=CC=C4OC3=O)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1N2C=NC3=C2C4=CC=CC=C4OC3=O)CC5=CC=CC=C5

InChI

InChI=1S/C22H21N3O2/c26-22-20-21(18-8-4-5-9-19(18)27-22)25(15-23-20)17-10-12-24(13-11-17)14-16-6-2-1-3-7-16/h1-9,15,17H,10-14H2/p+1