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

Systemtic Name: N'-[6-(naphthalen-1-ylamino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Openeye Name: N'-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide CAS Name: N'-[6-(1-naphthalenylamino)-5-nitro-4-pyrimidinyl]-4-nitrobenzohydrazide IUPAC Name: N'-[6-(naphthalen-1-ylamino)-5-nitropyrimidin-4-yl]-4-nitrobenzohydrazide Traditional Name: N'-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Formula: C21H15N7O5 MolecularWeight: 445.3877

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H15N7O5/c29-21(14-8-10-15(11-9-14)27(30)31)26-25-20-18(28(32)33)19(22-12-23-20)24-17-7-3-5-13-4-1-2-6-16(13)17/h1-12H,(H,26,29)(H2,22,23,24,25)