4-chloranyl-N'-[6-(3-morpholin-4-ylpropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-(3-morpholin-4-ylpropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-[3-(4-morpholinyl)propylamino]-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-(3-morpholin-4-ylpropylamino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C18H21ClN8O6 MolecularWeight: 480.86234

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCNC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H21ClN8O6/c19-13-3-2-12(10-14(13)26(29)30)18(28)24-23-17-15(27(31)32)16(21-11-22-17)20-4-1-5-25-6-8-33-9-7-25/h2-3,10-11H,1,4-9H2,(H,24,28)(H2,20,21,22,23)