(4-nitrophenyl)methyl adamantane-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl adamantane-1-carboxylate Openeye Name: (4-nitrophenyl)methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (4-nitrobenzyl) ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H21NO4/c20-17(23-11-12-1-3-16(4-2-12)19(21)22)18-8-13-5-14(9-18)7-15(6-13)10-18/h1-4,13-15H,5-11H2