2-[5-[2-(1-oxidanylidene-4-phenyl-phthalazin-2-yl)ethoxy]-2,3-dihydro-1H-inden-1-yl]butanoic acid

Systemtic Name: 2-[5-[2-(1-oxidanylidene-4-phenyl-phthalazin-2-yl)ethoxy]-2,3-dihydro-1H-inden-1-yl]butanoic acid Openeye Name: 2-[5-[2-(1-oxo-4-phenyl-phthalazin-2-yl)ethoxy]indan-1-yl]butanoic acid CAS Name: 2-[5-[2-(1-oxo-4-phenyl-2-phthalazinyl)ethoxy]-2,3-dihydro-1H-inden-1-yl]butanoic acid IUPAC Name: 2-[5-[2-(1-oxo-4-phenylphthalazin-2-yl)ethoxy]-2,3-dihydro-1H-inden-1-yl]butanoic acid Traditional Name: 2-[5-[2-(1-keto-4-phenyl-phthalazin-2-yl)ethoxy]indan-1-yl]butyric acid Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCC2=C1C=CC(=C2)OCCN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CCC(C1CCC2=C1C=CC(=C2)OCCN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C29H28N2O4/c1-2-22(29(33)34)24-14-12-20-18-21(13-15-23(20)24)35-17-16-31-28(32)26-11-7-6-10-25(26)27(30-31)19-8-4-3-5-9-19/h3-11,13,15,18,22,24H,2,12,14,16-17H2,1H3,(H,33,34)