[6-[(phenylmethyl)amino]pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [6-[(phenylmethyl)amino]pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [6-(benzylamino)pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [6-[(phenylmethyl)amino]-3-pyridin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [6-(benzylamino)pyridin-1-ium-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [6-(benzylamino)pyridin-1-ium-3-yl]-pyrrolidino-methanone Formula: C17H20N3O+ MolecularWeight: 282.3602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C[NH+]=C(C=C2)NCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)C2=C[NH+]=C(C=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C17H19N3O/c21-17(20-10-4-5-11-20)15-8-9-16(19-13-15)18-12-14-6-2-1-3-7-14/h1-3,6-9,13H,4-5,10-12H2,(H,18,19)/p+1