2-[(Z)-(1-adamantylcarbamoylhydrazinylidene)methyl]-4-chloranyl-6-nitro-phenolate

Systemtic Name: 2-[(Z)-(1-adamantylcarbamoylhydrazinylidene)methyl]-4-chloranyl-6-nitro-phenolate Openeye Name: 2-[(Z)-(1-adamantylcarbamoylhydrazono)methyl]-4-chloro-6-nitro-phenolate CAS Name: 2-[(Z)-[[(1-adamantylamino)-oxomethyl]hydrazinylidene]methyl]-4-chloro-6-nitrophenolate IUPAC Name: 2-[(Z)-(1-adamantylcarbamoylhydrazinylidene)methyl]-4-chloro-6-nitrophenolate Traditional Name: 2-[(Z)-(1-adamantylcarbamoylhydrazono)methyl]-4-chloro-6-nitro-phenolate Formula: C18H20ClN4O4- MolecularWeight: 391.8288

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NN=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN4O4/c19-14-4-13(16(24)15(5-14)23(26)27)9-20-22-17(25)21-18-6-10-1-11(7-18)3-12(2-10)8-18/h4-5,9-12,24H,1-3,6-8H2,(H2,21,22,25)/p-1/b20-9-