N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]quinoline-2-carboxamide

Systemtic Name: N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]quinoline-2-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]quinoline-2-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-2-quinolinecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]quinoline-2-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]quinaldamide Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=NC3=CC=CC=C3C=C2)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=NC3=CC=CC=C3C=C2)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2/c28-22(24-18-7-2-1-3-8-18)16-27-14-12-19(13-15-27)25-23(29)21-11-10-17-6-4-5-9-20(17)26-21/h1-11,19H,12-16H2,(H,24,28)(H,25,29)/p+1