4-[1-(4-oxidanyl-4-oxidanylidene-butyl)perylen-2-yl]butanoic acid

Systemtic Name: 4-[1-(4-oxidanyl-4-oxidanylidene-butyl)perylen-2-yl]butanoic acid Openeye Name: 4-[1-(4-hydroxy-4-oxo-butyl)perylen-2-yl]butanoic acid CAS Name: 4-[1-(4-hydroxy-4-oxobutyl)-2-perylenyl]butanoic acid IUPAC Name: 4-[1-(4-hydroxy-4-oxobutyl)perylen-2-yl]butanoic acid Traditional Name: 4-[1-(4-hydroxy-4-keto-butyl)perylen-2-yl]butyric acid Formula: C28H24O4 MolecularWeight: 424.48776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C4=CC=CC5=CC(=C(C(=C54)C3=CC=C2)CCCC(=O)O)CCCC(=O)O

Isomeric SMILES

C1=CC2=C3C(=C1)C4=CC=CC5=CC(=C(C(=C54)C3=CC=C2)CCCC(=O)O)CCCC(=O)O

InChI

InChI=1S/C28H24O4/c29-24(30)14-4-8-18-16-19-9-3-12-22-21-11-1-6-17-7-2-13-23(26(17)21)28(27(19)22)20(18)10-5-15-25(31)32/h1-3,6-7,9,11-13,16H,4-5,8,10,14-15H2,(H,29,30)(H,31,32)