4-(5-methoxycarbonyl-4-methyl-2-oxidanylidene-6-phenanthren-9-yl-1,6-dihydropyrimidin-3-yl)butanoic acid

Systemtic Name: 4-(5-methoxycarbonyl-4-methyl-2-oxidanylidene-6-phenanthren-9-yl-1,6-dihydropyrimidin-3-yl)butanoic acid Openeye Name: 4-[5-methoxycarbonyl-4-methyl-2-oxo-6-(9-phenanthryl)-1,6-dihydropyrimidin-3-yl]butanoic acid CAS Name: 4-[5-methoxycarbonyl-4-methyl-2-oxo-6-(9-phenanthrenyl)-1,6-dihydropyrimidin-3-yl]butanoic acid IUPAC Name: 4-(5-methoxycarbonyl-4-methyl-2-oxo-6-phenanthren-9-yl-1,6-dihydropyrimidin-3-yl)butanoic acid Traditional Name: 4-[5-carbomethoxy-2-keto-4-methyl-6-(9-phenanthryl)-1,6-dihydropyrimidin-3-yl]butyric acid Formula: C25H24N2O5 MolecularWeight: 432.46846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC3=CC=CC=C3C4=CC=CC=C42)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC3=CC=CC=C3C4=CC=CC=C42)C(=O)OC

InChI

InChI=1S/C25H24N2O5/c1-15-22(24(30)32-2)23(26-25(31)27(15)13-7-12-21(28)29)20-14-16-8-3-4-9-17(16)18-10-5-6-11-19(18)20/h3-6,8-11,14,23H,7,12-13H2,1-2H3,(H,26,31)(H,28,29)