(4-aminocarbonyl-2-nitro-phenyl)methyl 3-oxidanyladamantane-1-carboxylate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-oxidanyladamantane-1-carboxylate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O6/c20-16(22)13-1-2-14(15(4-13)21(25)26)9-27-17(23)18-5-11-3-12(6-18)8-19(24,7-11)10-18/h1-2,4,11-12,24H,3,5-10H2,(H2,20,22)