2-chloranyl-N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]pyridine-4-carboxamide

Systemtic Name: 2-chloranyl-N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]pyridine-4-carboxamide Openeye Name: 2-chloro-N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]pyridine-4-carboxamide CAS Name: 2-chloro-N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]pyridine-4-carboxamide Traditional Name: 2-chloro-N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]isonicotinamide Formula: C20H23ClN3O+ MolecularWeight: 356.86912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CC3=CC=CC=C3C2)NC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CC3=CC=CC=C3C2)NC(=O)C4=CC(=NC=C4)Cl

InChI

InChI=1S/C20H22ClN3O/c21-19-12-16(7-8-22-19)20(25)23-17-6-3-9-24(13-17)18-10-14-4-1-2-5-15(14)11-18/h1-2,4-5,7-8,12,17-18H,3,6,9-11,13H2,(H,23,25)/p+1/t17-/m0/s1