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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC=C)(C1=CN=CN=C1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)C(CCCC=C)(C1=CN=CN=C1C2=CC=CC=C2)C(=O)O

InChI

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