1-methyl-2-(piperidin-1-ium-1-ylmethyl)indole-3-carbonitrile

Systemtic Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)indole-3-carbonitrile Openeye Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)indole-3-carbonitrile CAS Name: 1-methyl-2-(1-piperidin-1-iumylmethyl)-3-indolecarbonitrile IUPAC Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)indole-3-carbonitrile Traditional Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)indole-3-carbonitrile Formula: C16H20N3+ MolecularWeight: 254.3501

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C[NH+]3CCCCC3)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C[NH+]3CCCCC3)C#N

InChI

InChI=1S/C16H19N3/c1-18-15-8-4-3-7-13(15)14(11-17)16(18)12-19-9-5-2-6-10-19/h3-4,7-8H,2,5-6,9-10,12H2,1H3/p+1