(2,3-dimethyl-1H-indol-5-yl)methyl-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (2,3-dimethyl-1H-indol-5-yl)methyl-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (2,3-dimethyl-1H-indol-5-yl)methyl-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]ammonium CAS Name: (2,3-dimethyl-1H-indol-5-yl)methyl-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (2,3-dimethyl-1H-indol-5-yl)methyl-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]azanium Traditional Name: (2,3-dimethyl-1H-indol-5-yl)methyl-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]ammonium Formula: C22H30N4+2 MolecularWeight: 350.5004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C[NH2+]C3CC[NH+](CC3)CC4=CN=CC=C4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C[NH2+]C3CC[NH+](CC3)CC4=CN=CC=C4)C

InChI

InChI=1S/C22H28N4/c1-16-17(2)25-22-6-5-18(12-21(16)22)14-24-20-7-10-26(11-8-20)15-19-4-3-9-23-13-19/h3-6,9,12-13,20,24-25H,7-8,10-11,14-15H2,1-2H3/p+2