2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]quinoline-3-carboxamide

Systemtic Name: 2,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]quinoline-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-quinoline-3-carboxamide CAS Name: 2,6-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-quinolinecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethylquinoline-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,6-dimethyl-quinoline-3-carboxamide Formula: C24H28N3O+ MolecularWeight: 374.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O/c1-17-8-9-23-20(14-17)15-22(18(2)25-23)24(28)26-21-10-12-27(13-11-21)16-19-6-4-3-5-7-19/h3-9,14-15,21H,10-13,16H2,1-2H3,(H,26,28)/p+1