3-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethoxy]aniline

Systemtic Name: 3-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethoxy]aniline Openeye Name: 3-[2-(4-benzylpiperidin-1-ium-1-yl)ethoxy]aniline CAS Name: 3-[2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethoxy]aniline IUPAC Name: 3-[2-(4-benzylpiperidin-1-ium-1-yl)ethoxy]aniline Traditional Name: [3-[2-(4-benzylpiperidin-1-ium-1-yl)ethoxy]phenyl]amine Formula: C20H27N2O+ MolecularWeight: 311.44118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CCOC3=CC=CC(=C3)N

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CCOC3=CC=CC(=C3)N

InChI

InChI=1S/C20H26N2O/c21-19-7-4-8-20(16-19)23-14-13-22-11-9-18(10-12-22)15-17-5-2-1-3-6-17/h1-8,16,18H,9-15,21H2/p+1