16-methyl-2-(2-methylprop-2-enoyl)-2-propan-2-yl-heptadecanoic acid

Systemtic Name: 16-methyl-2-(2-methylprop-2-enoyl)-2-propan-2-yl-heptadecanoic acid Openeye Name: 2-isopropyl-16-methyl-2-(2-methylprop-2-enoyl)heptadecanoic acid CAS Name: 16-methyl-2-(2-methyl-1-oxoprop-2-enyl)-2-propan-2-ylheptadecanoic acid IUPAC Name: 16-methyl-2-(2-methylprop-2-enoyl)-2-propan-2-ylheptadecanoic acid Traditional Name: 2-isopropyl-3-keto-4-methyl-2-(14-methylpentadecyl)pent-4-enoic acid Formula: C25H46O3 MolecularWeight: 394.63094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCC(C(C)C)(C(=O)C(=C)C)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCCC(C(C)C)(C(=O)C(=C)C)C(=O)O

InChI

InChI=1S/C25H46O3/c1-20(2)18-16-14-12-10-8-7-9-11-13-15-17-19-25(22(5)6,24(27)28)23(26)21(3)4/h20,22H,3,7-19H2,1-2,4-6H3,(H,27,28)