N-(4-methylpyridin-2-yl)-3-(4-methylpyridin-2-yl)imino-5-nitro-isoindol-1-amine

Systemtic Name: N-(4-methylpyridin-2-yl)-3-(4-methylpyridin-2-yl)imino-5-nitro-isoindol-1-amine Openeye Name: N-(4-methyl-2-pyridyl)-3-[(4-methyl-2-pyridyl)imino]-5-nitro-isoindol-1-amine CAS Name: N-(4-methyl-2-pyridinyl)-3-[(4-methyl-2-pyridinyl)imino]-5-nitro-1-isoindolamine IUPAC Name: N-(4-methylpyridin-2-yl)-3-(4-methylpyridin-2-yl)imino-5-nitroisoindol-1-amine Traditional Name: (4-methyl-2-pyridyl)-[3-[(4-methyl-2-pyridyl)imino]-5-nitro-isoindol-1-yl]amine Formula: C20H16N6O2 MolecularWeight: 372.38004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC2=NC(=NC3=NC=CC(=C3)C)C4=C2C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC=C1)NC2=NC(=NC3=NC=CC(=C3)C)C4=C2C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O2/c1-12-5-7-21-17(9-12)23-19-15-4-3-14(26(27)28)11-16(15)20(25-19)24-18-10-13(2)6-8-22-18/h3-11H,1-2H3,(H,21,22,23,24,25)