1H-indol-3-ylmethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: 1H-indol-3-ylmethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-(1H-indol-3-ylmethyl)ammonium CAS Name: 1H-indol-3-ylmethyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-(1H-indol-3-ylmethyl)azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(1H-indol-3-ylmethyl)ammonium Formula: C21H27N3+2 MolecularWeight: 321.45918

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH2+]CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1[NH2+]CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C21H25N3/c1-2-6-17(7-3-1)16-24-12-10-19(11-13-24)22-14-18-15-23-21-9-5-4-8-20(18)21/h1-9,15,19,22-23H,10-14,16H2/p+2