1-[[(5-methylpyridin-1-ium-2-yl)amino]methyl]indole-2,3-dione

Systemtic Name: 1-[[(5-methylpyridin-1-ium-2-yl)amino]methyl]indole-2,3-dione Openeye Name: 1-[[(5-methylpyridin-1-ium-2-yl)amino]methyl]indoline-2,3-dione CAS Name: 1-[[(5-methyl-2-pyridin-1-iumyl)amino]methyl]indole-2,3-dione IUPAC Name: 1-[[(5-methylpyridin-1-ium-2-yl)amino]methyl]indole-2,3-dione Traditional Name: 1-[[(5-methylpyridin-1-ium-2-yl)amino]methyl]isatin Formula: C15H14N3O2+ MolecularWeight: 268.29056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)NCN2C3=CC=CC=C3C(=O)C2=O

Isomeric SMILES

CC1=C[NH+]=C(C=C1)NCN2C3=CC=CC=C3C(=O)C2=O

InChI

InChI=1S/C15H13N3O2/c1-10-6-7-13(16-8-10)17-9-18-12-5-3-2-4-11(12)14(19)15(18)20/h2-8H,9H2,1H3,(H,16,17)/p+1