1-(4-methoxy-3,5-dinitro-phenyl)adamantane

Systemtic Name: 1-(4-methoxy-3,5-dinitro-phenyl)adamantane Openeye Name: 1-(4-methoxy-3,5-dinitro-phenyl)adamantane CAS Name: 1-(4-methoxy-3,5-dinitrophenyl)adamantane IUPAC Name: 1-(4-methoxy-3,5-dinitrophenyl)adamantane Traditional Name: 1-(4-methoxy-3,5-dinitro-phenyl)adamantane Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O5/c1-24-16-14(18(20)21)5-13(6-15(16)19(22)23)17-7-10-2-11(8-17)4-12(3-10)9-17/h5-6,10-12H,2-4,7-9H2,1H3