2-[(4-butylphenyl)carbonylamino]-4-dibenzofuran-2-yl-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[(4-butylphenyl)carbonylamino]-4-dibenzofuran-2-yl-4-oxidanylidene-butanoic acid Openeye Name: 2-[(4-butylbenzoyl)amino]-4-dibenzofuran-2-yl-4-oxo-butanoic acid CAS Name: 2-[[(4-butylphenyl)-oxomethyl]amino]-4-(2-dibenzofuranyl)-4-oxobutanoic acid IUPAC Name: 2-[(4-butylbenzoyl)amino]-4-dibenzofuran-2-yl-4-oxobutanoic acid Traditional Name: 2-[(4-butylbenzoyl)amino]-4-dibenzofuran-2-yl-4-keto-butyric acid Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(CC(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC(CC(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C27H25NO5/c1-2-3-6-17-9-11-18(12-10-17)26(30)28-22(27(31)32)16-23(29)19-13-14-25-21(15-19)20-7-4-5-8-24(20)33-25/h4-5,7-15,22H,2-3,6,16H2,1H3,(H,28,30)(H,31,32)