4-chloranyl-3-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide CAS Name: 4-chloro-3-nitro-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]benzamide Formula: C21H18ClN5O3 MolecularWeight: 423.85232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN5O3/c22-17-7-6-15(13-19(17)27(29)30)21(28)23-16-5-3-4-14(12-16)18-8-9-20(25-24-18)26-10-1-2-11-26/h3-9,12-13H,1-2,10-11H2,(H,23,28)