2-[[2-(dibenzofuran-4-ylcarbonylamino)-4-methyl-pentanoyl]amino]-3-(4-morpholin-4-ylcarbonyloxyphenyl)propanoic acid

Systemtic Name: 2-[[2-(dibenzofuran-4-ylcarbonylamino)-4-methyl-pentanoyl]amino]-3-(4-morpholin-4-ylcarbonyloxyphenyl)propanoic acid Openeye Name: 2-[[2-(dibenzofuran-4-carbonylamino)-4-methyl-pentanoyl]amino]-3-[4-(morpholine-4-carbonyloxy)phenyl]propanoic acid CAS Name: 2-[[2-[[4-dibenzofuranyl(oxo)methyl]amino]-4-methyl-1-oxopentyl]amino]-3-[4-[4-morpholinyl(oxo)methoxy]phenyl]propanoic acid IUPAC Name: 2-[[2-(dibenzofuran-4-carbonylamino)-4-methylpentanoyl]amino]-3-[4-(morpholine-4-carbonyloxy)phenyl]propanoic acid Traditional Name: 2-[[2-(dibenzofuran-4-carbonylamino)-4-methyl-pentanoyl]amino]-3-[4-(morpholine-4-carbonyloxy)phenyl]propionic acid Formula: C33H35N3O8 MolecularWeight: 601.6463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OC(=O)N2CCOCC2)C(=O)O)NC(=O)C3=CC=CC4=C3OC5=CC=CC=C45

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OC(=O)N2CCOCC2)C(=O)O)NC(=O)C3=CC=CC4=C3OC5=CC=CC=C45

InChI

InChI=1S/C33H35N3O8/c1-20(2)18-26(34-30(37)25-8-5-7-24-23-6-3-4-9-28(23)44-29(24)25)31(38)35-27(32(39)40)19-21-10-12-22(13-11-21)43-33(41)36-14-16-42-17-15-36/h3-13,20,26-27H,14-19H2,1-2H3,(H,34,37)(H,35,38)(H,39,40)