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2-[(3-benzamido-1-adamantyl)oxy]ethyl 4-nitrobenzoate

2-[(3-benzamido-1-adamantyl)oxy]ethyl 4-nitrobenzoate

Systemtic Name:2-[(3-benzamido-1-adamantyl)oxy]ethyl 4-nitrobenzoate
Openeye Name:2-[(3-benzamido-1-adamantyl)oxy]ethyl 4-nitrobenzoate
CAS Name:4-nitrobenzoic acid 2-[(3-benzamido-1-adamantyl)oxy]ethyl ester
IUPAC Name:2-[(3-benzamido-1-adamantyl)oxy]ethyl 4-nitrobenzoate
Traditional Name:4-nitrobenzoic acid 2-[(3-benzamido-1-adamantyl)oxy]ethyl ester
Formula: C26H28N2O6
MolecularWeight: 464.51032
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)OCCOC(=O)C4=CC=C(C=C4)[N+](=O)[O-])NC(=O)C5=CC=CC=C5


Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)OCCOC(=O)C4=CC=C(C=C4)[N+](=O)[O-])NC(=O)C5=CC=CC=C5


InChI

InChI=1S/C26H28N2O6/c29-23(20-4-2-1-3-5-20)27-25-13-18-12-19(14-25)16-26(15-18,17-25)34-11-10-33-24(30)21-6-8-22(9-7-21)28(31)32/h1-9,18-19H,10-17H2,(H,27,29)


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