2-[4-(1,2-dihydroacenaphthylen-5-ylcarbonyl)phenyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[4-(1,2-dihydroacenaphthylen-5-ylcarbonyl)phenyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[4-(1,2-dihydroacenaphthylene-5-carbonyl)phenyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[4-[1,2-dihydroacenaphthylen-5-yl(oxo)methyl]phenyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[4-(1,2-dihydroacenaphthylene-5-carbonyl)phenyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[4-(acenaphthene-5-carbonyl)phenyl]-5-nitro-isoindoline-1,3-quinone Formula: C27H16N2O5 MolecularWeight: 448.42634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)C(=O)C4=CC=C(C=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)C(=O)C4=CC=C(C=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C27H16N2O5/c30-25(21-12-8-16-5-4-15-2-1-3-20(21)24(15)16)17-6-9-18(10-7-17)28-26(31)22-13-11-19(29(33)34)14-23(22)27(28)32/h1-3,6-14H,4-5H2