[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]oxycarbonyl-2,6-dimethyl-phenyl] acridine-9-carboxylate

Systemtic Name: [4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]oxycarbonyl-2,6-dimethyl-phenyl] acridine-9-carboxylate Openeye Name: [4-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-2,6-dimethyl-phenyl] acridine-9-carboxylate CAS Name: 9-acridinecarboxylic acid [4-[(2,5-dioxo-1-pyrrolidinyl)oxy-oxomethyl]-2,6-dimethylphenyl] ester IUPAC Name: [4-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-2,6-dimethylphenyl] acridine-9-carboxylate Traditional Name: acridine-9-carboxylic acid (2,6-dimethyl-4-succinimidooxycarbonyl-phenyl) ester Formula: C27H20N2O6 MolecularWeight: 468.4575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)C(=O)ON5C(=O)CCC5=O

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)C(=O)ON5C(=O)CCC5=O

InChI

InChI=1S/C27H20N2O6/c1-15-13-17(26(32)35-29-22(30)11-12-23(29)31)14-16(2)25(15)34-27(33)24-18-7-3-5-9-20(18)28-21-10-6-4-8-19(21)24/h3-10,13-14H,11-12H2,1-2H3