N-(4-morpholin-4-yl-3-nitro-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-morpholin-4-yl-3-nitro-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-morpholino-3-nitro-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-(4-morpholinyl)-3-nitrophenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-morpholin-4-yl-3-nitrophenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-morpholino-3-nitro-phenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C21H23N5O6 MolecularWeight: 441.43722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O6/c27-21(15-3-5-17(19(13-15)25(28)29)23-7-1-2-8-23)22-16-4-6-18(20(14-16)26(30)31)24-9-11-32-12-10-24/h3-6,13-14H,1-2,7-12H2,(H,22,27)