1,4-dimethyl-4-(trinitromethyl)naphthalen-1-ol

Systemtic Name: 1,4-dimethyl-4-(trinitromethyl)naphthalen-1-ol Openeye Name: 1,4-dimethyl-4-(trinitromethyl)naphthalen-1-ol CAS Name: 1,4-dimethyl-4-(trinitromethyl)-1-naphthalenol IUPAC Name: 1,4-dimethyl-4-(trinitromethyl)naphthalen-1-ol Traditional Name: 1,4-dimethyl-4-(trinitromethyl)-1-naphthol Formula: C13H13N3O7 MolecularWeight: 323.25822

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(C2=CC=CC=C21)(C)O)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1(C=CC(C2=CC=CC=C21)(C)O)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O7/c1-11(13(14(18)19,15(20)21)16(22)23)7-8-12(2,17)10-6-4-3-5-9(10)11/h3-8,17H,1-2H3