1-naphthalen-2-yl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-naphthalen-2-yl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(2-naphthyl)-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-(2-naphthalenyl)-4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-naphthalen-2-yl-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-(2-naphthyl)-4-(4-pyridin-1-ium-2-ylpiperazino)butane-1,4-dione Formula: C23H24N3O2+ MolecularWeight: 374.45556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O2/c27-21(20-9-8-18-5-1-2-6-19(18)17-20)10-11-23(28)26-15-13-25(14-16-26)22-7-3-4-12-24-22/h1-9,12,17H,10-11,13-16H2/p+1