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

Systemtic Name: 6-(4-methyl-2-oxidanylidene-6-phenanthren-9-yl-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl)hexanoic acid Openeye Name: 6-[5-benzyloxycarbonyl-4-methyl-2-oxo-6-(9-phenanthryl)-1,6-dihydropyrimidin-3-yl]hexanoic acid CAS Name: 6-[4-methyl-2-oxo-6-(9-phenanthrenyl)-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl]hexanoic acid IUPAC Name: 6-(4-methyl-2-oxo-6-phenanthren-9-yl-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl)hexanoic acid Traditional Name: 6-[5-carbobenzoxy-2-keto-4-methyl-6-(9-phenanthryl)-1,6-dihydropyrimidin-3-yl]hexanoic acid Formula: C33H32N2O5 MolecularWeight: 536.61758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCCCC(=O)O)C2=CC3=CC=CC=C3C4=CC=CC=C42)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCCCC(=O)O)C2=CC3=CC=CC=C3C4=CC=CC=C42)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C33H32N2O5/c1-22-30(32(38)40-21-23-12-4-2-5-13-23)31(34-33(39)35(22)19-11-3-6-18-29(36)37)28-20-24-14-7-8-15-25(24)26-16-9-10-17-27(26)28/h2,4-5,7-10,12-17,20,31H,3,6,11,18-19,21H2,1H3,(H,34,39)(H,36,37)