N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-nitro-benzamide

Systemtic Name: N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-nitro-benzamide Openeye Name: N-[3-(6-morpholinopyridazin-3-yl)phenyl]-2-nitro-benzamide CAS Name: N-[3-[6-(4-morpholinyl)-3-pyridazinyl]phenyl]-2-nitrobenzamide IUPAC Name: N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-nitrobenzamide Traditional Name: N-[3-(6-morpholinopyridazin-3-yl)phenyl]-2-nitro-benzamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O4/c27-21(17-6-1-2-7-19(17)26(28)29)22-16-5-3-4-15(14-16)18-8-9-20(24-23-18)25-10-12-30-13-11-25/h1-9,14H,10-13H2,(H,22,27)