2-(2-phenyl-4-propan-2-yl-pyrimidin-5-yl)hept-6-enoic acid

Systemtic Name: 2-(2-phenyl-4-propan-2-yl-pyrimidin-5-yl)hept-6-enoic acid Openeye Name: 2-(4-isopropyl-2-phenyl-pyrimidin-5-yl)hept-6-enoic acid CAS Name: 2-(2-phenyl-4-propan-2-yl-5-pyrimidinyl)-6-heptenoic acid IUPAC Name: 2-(2-phenyl-4-propan-2-ylpyrimidin-5-yl)hept-6-enoic acid Traditional Name: 2-(4-isopropyl-2-phenyl-pyrimidin-5-yl)hept-6-enoic acid Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC=C1C(CCCC=C)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NC(=NC=C1C(CCCC=C)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C20H24N2O2/c1-4-5-7-12-16(20(23)24)17-13-21-19(22-18(17)14(2)3)15-10-8-6-9-11-15/h4,6,8-11,13-14,16H,1,5,7,12H2,2-3H3,(H,23,24)