[2-(phenethylamino)pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-(phenethylamino)pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [2-(phenethylamino)pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [2-(phenethylamino)-3-pyridin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-(phenethylamino)pyridin-1-ium-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [2-(phenethylamino)pyridin-1-ium-3-yl]-pyrrolidino-methanone Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C([NH+]=CC=C2)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)C2=C([NH+]=CC=C2)NCCC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O/c22-18(21-13-4-5-14-21)16-9-6-11-19-17(16)20-12-10-15-7-2-1-3-8-15/h1-3,6-9,11H,4-5,10,12-14H2,(H,19,20)/p+1