N-(1-propylpiperidin-1-ium-4-yl)-9H-xanthene-9-carboxamide

Systemtic Name: N-(1-propylpiperidin-1-ium-4-yl)-9H-xanthene-9-carboxamide Openeye Name: N-(1-propylpiperidin-1-ium-4-yl)-9H-xanthene-9-carboxamide CAS Name: N-(1-propyl-4-piperidin-1-iumyl)-9H-xanthene-9-carboxamide IUPAC Name: N-(1-propylpiperidin-1-ium-4-yl)-9H-xanthene-9-carboxamide Traditional Name: N-(1-propylpiperidin-1-ium-4-yl)-9H-xanthene-9-carboxamide Formula: C22H27N2O2+ MolecularWeight: 351.46198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C22H26N2O2/c1-2-13-24-14-11-16(12-15-24)23-22(25)21-17-7-3-5-9-19(17)26-20-10-6-4-8-18(20)21/h3-10,16,21H,2,11-15H2,1H3,(H,23,25)/p+1