(3-nitrophenyl) 4-(1-adamantyl)benzoate

Systemtic Name: (3-nitrophenyl) 4-(1-adamantyl)benzoate Openeye Name: (3-nitrophenyl) 4-(1-adamantyl)benzoate CAS Name: 4-(1-adamantyl)benzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 4-(1-adamantyl)benzoate Traditional Name: 4-(1-adamantyl)benzoic acid (3-nitrophenyl) ester Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)C(=O)OC5=CC=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)C(=O)OC5=CC=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H23NO4/c25-22(28-21-3-1-2-20(11-21)24(26)27)18-4-6-19(7-5-18)23-12-15-8-16(13-23)10-17(9-15)14-23/h1-7,11,15-17H,8-10,12-14H2