2-(4-methylpyridin-1-ium-2-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-methylpyridin-1-ium-2-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-methylpyridin-1-ium-2-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-methyl-2-pyridin-1-iumyl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-methylpyridin-1-ium-2-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-methylpyridin-1-ium-2-yl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C18H12N3O4+ MolecularWeight: 334.30558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C18H11N3O4/c1-10-7-8-19-15(9-10)20-17(22)12-4-2-3-11-14(21(24)25)6-5-13(16(11)12)18(20)23/h2-9H,1H3/p+1