2-[2-[6-oxidanylidene-2-phenyl-5-(propan-2-yloxycarbonylamino)pyrimidin-1-yl]ethanoylamino]butanedioic acid

Systemtic Name: 2-[2-[6-oxidanylidene-2-phenyl-5-(propan-2-yloxycarbonylamino)pyrimidin-1-yl]ethanoylamino]butanedioic acid Openeye Name: 2-[[2-[5-(isopropoxycarbonylamino)-6-oxo-2-phenyl-pyrimidin-1-yl]acetyl]amino]butanedioic acid CAS Name: 2-[[1-oxo-2-[6-oxo-5-[[oxo(propan-2-yloxy)methyl]amino]-2-phenyl-1-pyrimidinyl]ethyl]amino]butanedioic acid IUPAC Name: 2-[[2-[6-oxo-2-phenyl-5-(propan-2-yloxycarbonylamino)pyrimidin-1-yl]acetyl]amino]butanedioic acid Traditional Name: 2-[[2-[5-(isopropoxycarbonylamino)-6-keto-2-phenyl-pyrimidin-1-yl]acetyl]amino]succinic acid Formula: C20H22N4O8 MolecularWeight: 446.41068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=CN=C(N(C1=O)CC(=O)NC(CC(=O)O)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)NC1=CN=C(N(C1=O)CC(=O)NC(CC(=O)O)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N4O8/c1-11(2)32-20(31)23-14-9-21-17(12-6-4-3-5-7-12)24(18(14)28)10-15(25)22-13(19(29)30)8-16(26)27/h3-7,9,11,13H,8,10H2,1-2H3,(H,22,25)(H,23,31)(H,26,27)(H,29,30)