bis[3-(morpholin-4-ylmethyl)-5-nitro-4-oxidanyl-phenyl]methanone

Systemtic Name: bis[3-(morpholin-4-ylmethyl)-5-nitro-4-oxidanyl-phenyl]methanone Openeye Name: bis[4-hydroxy-3-(morpholinomethyl)-5-nitro-phenyl]methanone CAS Name: bis[4-hydroxy-3-(4-morpholinylmethyl)-5-nitrophenyl]methanone IUPAC Name: bis[4-hydroxy-3-(morpholin-4-ylmethyl)-5-nitrophenyl]methanone Traditional Name: bis[4-hydroxy-3-(morpholinomethyl)-5-nitro-phenyl]methanone Formula: C23H26N4O9 MolecularWeight: 502.47394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(C(=CC(=C2)C(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])O)CN4CCOCC4)[N+](=O)[O-])O

Isomeric SMILES

C1COCCN1CC2=C(C(=CC(=C2)C(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])O)CN4CCOCC4)[N+](=O)[O-])O

InChI

InChI=1S/C23H26N4O9/c28-21(15-9-17(13-24-1-5-35-6-2-24)22(29)19(11-15)26(31)32)16-10-18(14-25-3-7-36-8-4-25)23(30)20(12-16)27(33)34/h9-12,29-30H,1-8,13-14H2