N-(5-nitropyridin-2-yl)imino-N'-phenylazanyl-4-propan-2-yl-benzenecarboximidamide

Systemtic Name: N-(5-nitropyridin-2-yl)imino-N'-phenylazanyl-4-propan-2-yl-benzenecarboximidamide Openeye Name: N'-anilino-4-isopropyl-N-[(5-nitro-2-pyridyl)imino]benzamidine CAS Name: N'-anilino-N-[(5-nitro-2-pyridinyl)imino]-4-propan-2-ylbenzenecarboximidamide IUPAC Name: N'-anilino-N-(5-nitropyridin-2-yl)imino-4-propan-2-ylbenzenecarboximidamide Traditional Name: N'-anilino-4-isopropyl-N-[(5-nitro-2-pyridyl)imino]benzamidine Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=NNC2=CC=CC=C2)N=NC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C(=N\NC2=CC=CC=C2)/N=NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O2/c1-15(2)16-8-10-17(11-9-16)21(25-23-18-6-4-3-5-7-18)26-24-20-13-12-19(14-22-20)27(28)29/h3-15,23H,1-2H3/b25-21+,26-24?