2-[3-(4-acridin-9-ylcarbonylpiperazin-1-yl)phenyl]pentanedioic acid

Systemtic Name: 2-[3-(4-acridin-9-ylcarbonylpiperazin-1-yl)phenyl]pentanedioic acid Openeye Name: 2-[3-[4-(acridine-9-carbonyl)piperazin-1-yl]phenyl]pentanedioic acid CAS Name: 2-[3-[4-[9-acridinyl(oxo)methyl]-1-piperazinyl]phenyl]pentanedioic acid IUPAC Name: 2-[3-[4-(acridine-9-carbonyl)piperazin-1-yl]phenyl]pentanedioic acid Traditional Name: 2-[3-[4-(acridine-9-carbonyl)piperazino]phenyl]glutaric acid Formula: C29H27N3O5 MolecularWeight: 497.54178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(CCC(=O)O)C(=O)O)C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(CCC(=O)O)C(=O)O)C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53

InChI

InChI=1S/C29H27N3O5/c33-26(34)13-12-21(29(36)37)19-6-5-7-20(18-19)31-14-16-32(17-15-31)28(35)27-22-8-1-3-10-24(22)30-25-11-4-2-9-23(25)27/h1-11,18,21H,12-17H2,(H,33,34)(H,36,37)