6-methoxycarbonyl-7-methyl-6-phenyl-octanoic acid

Systemtic Name: 6-methoxycarbonyl-7-methyl-6-phenyl-octanoic acid Openeye Name: 6-methoxycarbonyl-7-methyl-6-phenyl-octanoic acid CAS Name: 6-methoxycarbonyl-7-methyl-6-phenyloctanoic acid IUPAC Name: 6-methoxycarbonyl-7-methyl-6-phenyloctanoic acid Traditional Name: 6-carbomethoxy-7-methyl-6-phenyl-caprylic acid Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCCC(=O)O)(C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)C(CCCCC(=O)O)(C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H24O4/c1-13(2)17(16(20)21-3,12-8-7-11-15(18)19)14-9-5-4-6-10-14/h4-6,9-10,13H,7-8,11-12H2,1-3H3,(H,18,19)