N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-4-morpholino-3-nitro-benzamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-4-morpholino-3-nitro-benzamide Formula: C21H23ClN4O5 MolecularWeight: 446.88412

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O5/c22-16-2-1-3-17(20(16)25-8-12-31-13-9-25)23-21(27)15-4-5-18(19(14-15)26(28)29)24-6-10-30-11-7-24/h1-5,14H,6-13H2,(H,23,27)