[4-[2-[2,5-bis(oxidanylidene)pyrrol-1-yl]ethyl]phenyl] acridine-9-carboxylate

Systemtic Name: [4-[2-[2,5-bis(oxidanylidene)pyrrol-1-yl]ethyl]phenyl] acridine-9-carboxylate Openeye Name: [4-[2-(2,5-dioxopyrrol-1-yl)ethyl]phenyl] acridine-9-carboxylate CAS Name: 9-acridinecarboxylic acid [4-[2-(2,5-dioxo-1-pyrrolyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(2,5-dioxopyrrol-1-yl)ethyl]phenyl] acridine-9-carboxylate Traditional Name: acridine-9-carboxylic acid [4-(2-maleimidoethyl)phenyl] ester Formula: C26H18N2O4 MolecularWeight: 422.43212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C(=O)OC4=CC=C(C=C4)CCN5C(=O)C=CC5=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C(=O)OC4=CC=C(C=C4)CCN5C(=O)C=CC5=O

InChI

InChI=1S/C26H18N2O4/c29-23-13-14-24(30)28(23)16-15-17-9-11-18(12-10-17)32-26(31)25-19-5-1-3-7-21(19)27-22-8-4-2-6-20(22)25/h1-14H,15-16H2