[4-(3-chloranylpyridin-2-yl)piperazin-1-yl]-(2-morpholin-4-yl-5-nitro-phenyl)methanone

Systemtic Name: [4-(3-chloranylpyridin-2-yl)piperazin-1-yl]-(2-morpholin-4-yl-5-nitro-phenyl)methanone Openeye Name: [4-(3-chloro-2-pyridyl)piperazin-1-yl]-(2-morpholino-5-nitro-phenyl)methanone CAS Name: [4-(3-chloro-2-pyridinyl)-1-piperazinyl]-[2-(4-morpholinyl)-5-nitrophenyl]methanone IUPAC Name: [4-(3-chloropyridin-2-yl)piperazin-1-yl]-(2-morpholin-4-yl-5-nitrophenyl)methanone Traditional Name: [4-(3-chloro-2-pyridyl)piperazino]-(2-morpholino-5-nitro-phenyl)methanone Formula: C20H22ClN5O4 MolecularWeight: 431.87278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)Cl)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)Cl)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C20H22ClN5O4/c21-17-2-1-5-22-19(17)24-6-8-25(9-7-24)20(27)16-14-15(26(28)29)3-4-18(16)23-10-12-30-13-11-23/h1-5,14H,6-13H2