N-(3-ethynylphenyl)-1-methyl-piperidin-1-ium-4-amine

Systemtic Name: N-(3-ethynylphenyl)-1-methyl-piperidin-1-ium-4-amine Openeye Name: N-(3-ethynylphenyl)-1-methyl-piperidin-1-ium-4-amine CAS Name: N-(3-ethynylphenyl)-1-methyl-4-piperidin-1-iumamine IUPAC Name: N-(3-ethynylphenyl)-1-methylpiperidin-1-ium-4-amine Traditional Name: (3-ethynylphenyl)-(1-methylpiperidin-1-ium-4-yl)amine Formula: C14H19N2+ MolecularWeight: 215.31406

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC2=CC=CC(=C2)C#C

Isomeric SMILES

C[NH+]1CCC(CC1)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C14H18N2/c1-3-12-5-4-6-14(11-12)15-13-7-9-16(2)10-8-13/h1,4-6,11,13,15H,7-10H2,2H3/p+1