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

Systemtic Name: 1-(4-methyl-3,5-dinitro-phenyl)adamantane Openeye Name: 1-(4-methyl-3,5-dinitro-phenyl)adamantane CAS Name: 1-(4-methyl-3,5-dinitrophenyl)adamantane IUPAC Name: 1-(4-methyl-3,5-dinitrophenyl)adamantane Traditional Name: 1-(4-methyl-3,5-dinitro-phenyl)adamantane Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O4/c1-10-15(18(20)21)5-14(6-16(10)19(22)23)17-7-11-2-12(8-17)4-13(3-11)9-17/h5-6,11-13H,2-4,7-9H2,1H3