4-dibenzofuran-2-yl-2-[[2,6-di(propanoyl)phenyl]carbamoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-dibenzofuran-2-yl-2-[[2,6-di(propanoyl)phenyl]carbamoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-dibenzofuran-2-yl-2-[[2,6-di(propanoyl)phenyl]carbamoylamino]-4-oxo-butanoic acid CAS Name: 2-[[[2,6-bis(1-oxopropyl)anilino]-oxomethyl]amino]-4-(2-dibenzofuranyl)-4-oxobutanoic acid IUPAC Name: 4-dibenzofuran-2-yl-2-[[2,6-di(propanoyl)phenyl]carbamoylamino]-4-oxobutanoic acid Traditional Name: 4-dibenzofuran-2-yl-2-[(2,6-dipropionylphenyl)carbamoylamino]-4-keto-butyric acid Formula: C29H26N2O7 MolecularWeight: 514.52594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H26N2O7/c1-3-22(32)18-9-7-10-19(23(33)4-2)27(18)31-29(37)30-21(28(35)36)15-24(34)16-12-13-26-20(14-16)17-8-5-6-11-25(17)38-26/h5-14,21H,3-4,15H2,1-2H3,(H,35,36)(H2,30,31,37)