1-(3,4-dinitrophenyl)-3,3,6-trimethyl-1,5-dinitro-2H-indene

Systemtic Name: 1-(3,4-dinitrophenyl)-3,3,6-trimethyl-1,5-dinitro-2H-indene Openeye Name: 1-(3,4-dinitrophenyl)-3,3,6-trimethyl-1,5-dinitro-indane CAS Name: 1-(3,4-dinitrophenyl)-3,3,6-trimethyl-1,5-dinitro-2H-indene IUPAC Name: 1-(3,4-dinitrophenyl)-3,3,6-trimethyl-1,5-dinitro-2H-indene Traditional Name: 1-(3,4-dinitrophenyl)-3,3,6-trimethyl-1,5-dinitro-indane Formula: C18H16N4O8 MolecularWeight: 416.34164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(CC2(C)C)(C3=CC(=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1)C(CC2(C)C)(C3=CC(=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O8/c1-10-6-13-12(8-15(10)20(25)26)17(2,3)9-18(13,22(29)30)11-4-5-14(19(23)24)16(7-11)21(27)28/h4-8H,9H2,1-3H3