(4-nitrophenyl)methyl 1-azanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 1-azanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 1-amino-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-amino-9,10-dioxo-2-anthracenecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 1-amino-9,10-dioxoanthracene-2-carboxylate Traditional Name: 1-amino-9,10-diketo-anthracene-2-carboxylic acid (4-nitrobenzyl) ester Formula: C22H14N2O6 MolecularWeight: 402.35636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])N

InChI

InChI=1S/C22H14N2O6/c23-19-17(22(27)30-11-12-5-7-13(8-6-12)24(28)29)10-9-16-18(19)21(26)15-4-2-1-3-14(15)20(16)25/h1-10H,11,23H2