3-(4-nitrophenyl)adamantane-1-carbonitrile

Systemtic Name: 3-(4-nitrophenyl)adamantane-1-carbonitrile Openeye Name: 3-(4-nitrophenyl)adamantane-1-carbonitrile CAS Name: 3-(4-nitrophenyl)-1-adamantanecarbonitrile IUPAC Name: 3-(4-nitrophenyl)adamantane-1-carbonitrile Traditional Name: 3-(4-nitrophenyl)adamantane-1-carbonitrile Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O2/c18-11-16-6-12-5-13(7-16)9-17(8-12,10-16)14-1-3-15(4-2-14)19(20)21/h1-4,12-13H,5-10H2