1,12-dimethyl-4,9-dinitro-benzo[c]phenanthrene-5,8-dicarboxylic acid

Systemtic Name: 1,12-dimethyl-4,9-dinitro-benzo[c]phenanthrene-5,8-dicarboxylic acid Openeye Name: 1,12-dimethyl-4,9-dinitro-benzo[c]phenanthrene-5,8-dicarboxylic acid CAS Name: 1,12-dimethyl-4,9-dinitrobenzo[c]phenanthrene-5,8-dicarboxylic acid IUPAC Name: 1,12-dimethyl-4,9-dinitrobenzo[c]phenanthrene-5,8-dicarboxylic acid Traditional Name: 1,12-dimethyl-4,9-dinitro-benzo[c]phenanthrene-5,8-dicarboxylic acid Formula: C22H14N2O8 MolecularWeight: 434.35516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)[N+](=O)[O-])C(=CC3=C2C4=C(C=CC(=C4C(=C3)C(=O)O)[N+](=O)[O-])C)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)[N+](=O)[O-])C(=CC3=C2C4=C(C=CC(=C4C(=C3)C(=O)O)[N+](=O)[O-])C)C(=O)O

InChI

InChI=1S/C22H14N2O8/c1-9-3-5-14(23(29)30)19-12(21(25)26)7-11-8-13(22(27)28)20-15(24(31)32)6-4-10(2)17(20)18(11)16(9)19/h3-8H,1-2H3,(H,25,26)(H,27,28)