methyl 2,5,7-trinitro-9-propan-2-ylidene-fluorene-4-carboxylate

Systemtic Name: methyl 2,5,7-trinitro-9-propan-2-ylidene-fluorene-4-carboxylate Openeye Name: methyl 9-isopropylidene-2,5,7-trinitro-fluorene-4-carboxylate CAS Name: 2,5,7-trinitro-9-propan-2-ylidene-4-fluorenecarboxylic acid methyl ester IUPAC Name: methyl 2,5,7-trinitro-9-propan-2-ylidenefluorene-4-carboxylate Traditional Name: 9-isopropylidene-2,5,7-trinitro-fluorene-4-carboxylic acid methyl ester Formula: C18H13N3O8 MolecularWeight: 399.31112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2=CC(=CC(=C2C3=C(C=C(C=C31)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC(=C1C2=CC(=CC(=C2C3=C(C=C(C=C31)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H13N3O8/c1-8(2)15-11-4-9(19(23)24)6-13(18(22)29-3)16(11)17-12(15)5-10(20(25)26)7-14(17)21(27)28/h4-7H,1-3H3