N'-[6-(naphthalen-1-ylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: N'-[6-(naphthalen-1-ylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-(1-naphthalenylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(naphthalen-1-ylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: N'-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C21H16N6O3 MolecularWeight: 400.39014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H16N6O3/c28-21(15-8-2-1-3-9-15)26-25-20-18(27(29)30)19(22-13-23-20)24-17-12-6-10-14-7-4-5-11-16(14)17/h1-13H,(H,26,28)(H2,22,23,24,25)