N-[[(3E)-2-morpholin-4-yl-3-[(3-nitrophenyl)methylidene]cyclopenten-1-yl]methylideneamino]adamantane-1-carboxamide

Systemtic Name: N-[[(3E)-2-morpholin-4-yl-3-[(3-nitrophenyl)methylidene]cyclopenten-1-yl]methylideneamino]adamantane-1-carboxamide Openeye Name: N-[[(3E)-2-morpholino-3-[(3-nitrophenyl)methylene]cyclopenten-1-yl]methyleneamino]adamantane-1-carboxamide CAS Name: N-[[(3E)-2-(4-morpholinyl)-3-[(3-nitrophenyl)methylidene]-1-cyclopentenyl]methylideneamino]-1-adamantanecarboxamide IUPAC Name: N-[[(3E)-2-morpholin-4-yl-3-[(3-nitrophenyl)methylidene]cyclopenten-1-yl]methylideneamino]adamantane-1-carboxamide Traditional Name: N-[[(3E)-2-morpholino-3-(3-nitrobenzylidene)cyclopenten-1-yl]methyleneamino]adamantane-1-carboxamide Formula: C28H34N4O4 MolecularWeight: 490.59396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1=CC2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3)C=NNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C\1CC(=C(/C1=C/C2=CC(=CC=C2)[N+](=O)[O-])N3CCOCC3)C=NNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H34N4O4/c33-27(28-15-20-10-21(16-28)12-22(11-20)17-28)30-29-18-24-5-4-23(26(24)31-6-8-36-9-7-31)13-19-2-1-3-25(14-19)32(34)35/h1-3,13-14,18,20-22H,4-12,15-17H2,(H,30,33)/b23-13+,29-18?