5-[3-(4-acridin-9-ylcarbonylpiperazin-1-yl)phenoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-(4-acridin-9-ylcarbonylpiperazin-1-yl)phenoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-[4-(acridine-9-carbonyl)piperazin-1-yl]phenoxy]-5-oxo-pentanoic acid CAS Name: 5-[3-[4-[9-acridinyl(oxo)methyl]-1-piperazinyl]phenoxy]-5-oxopentanoic acid IUPAC Name: 5-[3-[4-(acridine-9-carbonyl)piperazin-1-yl]phenoxy]-5-oxopentanoic acid Traditional Name: 5-[3-[4-(acridine-9-carbonyl)piperazino]phenoxy]-5-keto-valeric acid Formula: C29H27N3O5 MolecularWeight: 497.54178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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