(3-oxidanylnaphthalen-2-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (3-oxidanylnaphthalen-2-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (3-hydroxy-2-naphthyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (3-hydroxy-2-naphthalenyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (3-hydroxynaphthalen-2-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (3-hydroxy-2-naphthyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C20H20N3O2+ MolecularWeight: 334.3917

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC4=CC=CC=C4C=C3O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC4=CC=CC=C4C=C3O

InChI

InChI=1S/C20H19N3O2/c24-18-14-16-6-2-1-5-15(16)13-17(18)20(25)23-11-9-22(10-12-23)19-7-3-4-8-21-19/h1-8,13-14,24H,9-12H2/p+1