1-ethyl-3H-cyclopenta[a]naphthalene; 1,3,6-trinitrofluoren-9-one

Systemtic Name: 1-ethyl-3H-cyclopenta[a]naphthalene; 1,3,6-trinitrofluoren-9-one Openeye Name: 1-ethyl-3H-cyclopenta[a]naphthalene; 1,3,6-trinitrofluoren-9-one CAS Name: 1-ethyl-3H-cyclopenta[a]naphthalene; 1,3,6-trinitro-9-fluorenone IUPAC Name: 1-ethyl-3H-cyclopenta[a]naphthalene; 1,3,6-trinitrofluoren-9-one Traditional Name: 1-ethyl-3H-benz[e]indene; 1,3,6-trinitrofluoren-9-one Formula: C28H19N3O7 MolecularWeight: 509.46636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CCC2=C1C3=CC=CC=C3C=C2.C1=CC2=C(C=C1[N+](=O)[O-])C3=CC(=CC(=C3C2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CCC2=C1C3=CC=CC=C3C=C2.C1=CC2=C(C=C1[N+](=O)[O-])C3=CC(=CC(=C3C2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H14.C13H5N3O7/c1-2-11-7-9-13-10-8-12-5-3-4-6-14(12)15(11)13;17-13-8-2-1-6(14(18)19)3-9(8)10-4-7(15(20)21)5-11(12(10)13)16(22)23/h3-8,10H,2,9H2,1H3;1-5H