N-(2-adamantylideneamino)-5-[(2-chloranyl-5-nitro-phenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-(2-adamantylideneamino)-5-[(2-chloranyl-5-nitro-phenoxy)methyl]furan-2-carboxamide Openeye Name: N-(2-adamantylideneamino)-5-[(2-chloro-5-nitro-phenoxy)methyl]furan-2-carboxamide CAS Name: N-(2-adamantylideneamino)-5-[(2-chloro-5-nitrophenoxy)methyl]-2-furancarboxamide IUPAC Name: N-(2-adamantylideneamino)-5-[(2-chloro-5-nitrophenoxy)methyl]furan-2-carboxamide Traditional Name: N-(2-adamantylideneamino)-5-[(2-chloro-5-nitro-phenoxy)methyl]-2-furamide Formula: C22H22ClN3O5 MolecularWeight: 443.88018

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3=NNC(=O)C4=CC=C(O4)COC5=C(C=CC(=C5)[N+](=O)[O-])Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3=NNC(=O)C4=CC=C(O4)COC5=C(C=CC(=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H22ClN3O5/c23-18-3-1-16(26(28)29)10-20(18)30-11-17-2-4-19(31-17)22(27)25-24-21-14-6-12-5-13(8-14)9-15(21)7-12/h1-4,10,12-15H,5-9,11H2,(H,25,27)