1-(2,6-dimethyl-4-nitro-phenoxy)adamantane

Systemtic Name: 1-(2,6-dimethyl-4-nitro-phenoxy)adamantane Openeye Name: 1-(2,6-dimethyl-4-nitro-phenoxy)adamantane CAS Name: 1-(2,6-dimethyl-4-nitrophenoxy)adamantane IUPAC Name: 1-(2,6-dimethyl-4-nitrophenoxy)adamantane Traditional Name: 1-(2,6-dimethyl-4-nitro-phenoxy)adamantane Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC23CC4CC(C2)CC(C4)C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OC23CC4CC(C2)CC(C4)C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23NO3/c1-11-3-16(19(20)21)4-12(2)17(11)22-18-8-13-5-14(9-18)7-15(6-13)10-18/h3-4,13-15H,5-10H2,1-2H3