1-[3-(hydroxymethyl)phenyl]-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea

Systemtic Name: 1-[3-(hydroxymethyl)phenyl]-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[3-(hydroxymethyl)phenyl]urea CAS Name: 1-[3-(hydroxymethyl)phenyl]-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]urea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[3-(hydroxymethyl)phenyl]urea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(3-methylolphenyl)urea Formula: C20H26N3O2+ MolecularWeight: 340.43934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)NC2=CC=CC(=C2)CO)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)NC2=CC=CC(=C2)CO)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2/c24-15-17-7-4-8-19(13-17)22-20(25)21-18-9-11-23(12-10-18)14-16-5-2-1-3-6-16/h1-8,13,18,24H,9-12,14-15H2,(H2,21,22,25)/p+1