N-(1-adamantyl)-5-(2-chloranyl-4-nitro-phenyl)furan-2-carboxamide

Systemtic Name: N-(1-adamantyl)-5-(2-chloranyl-4-nitro-phenyl)furan-2-carboxamide Openeye Name: N-(1-adamantyl)-5-(2-chloro-4-nitro-phenyl)furan-2-carboxamide CAS Name: N-(1-adamantyl)-5-(2-chloro-4-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(1-adamantyl)-5-(2-chloro-4-nitrophenyl)furan-2-carboxamide Traditional Name: N-(1-adamantyl)-5-(2-chloro-4-nitro-phenyl)-2-furamide Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O4/c22-17-8-15(24(26)27)1-2-16(17)18-3-4-19(28-18)20(25)23-21-9-12-5-13(10-21)7-14(6-12)11-21/h1-4,8,12-14H,5-7,9-11H2,(H,23,25)