3-acetyloxy-4-(4-bromanyl-3a-methyl-3,4,5,6,7,7a-hexahydroinden-1-yl)pentanoic acid

Systemtic Name: 3-acetyloxy-4-(4-bromanyl-3a-methyl-3,4,5,6,7,7a-hexahydroinden-1-yl)pentanoic acid Openeye Name: 3-acetoxy-4-(4-bromo-3a-methyl-3,4,5,6,7,7a-hexahydroinden-1-yl)pentanoic acid CAS Name: 3-acetyloxy-4-(4-bromo-3a-methyl-3,4,5,6,7,7a-hexahydroinden-1-yl)pentanoic acid IUPAC Name: 3-acetyloxy-4-(4-bromo-3a-methyl-3,4,5,6,7,7a-hexahydroinden-1-yl)pentanoic acid Traditional Name: 3-acetoxy-4-(4-bromo-3a-methyl-3,4,5,6,7,7a-hexahydroinden-1-yl)valeric acid Formula: C17H25BrO4 MolecularWeight: 373.282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CCC2(C1CCCC2Br)C)C(CC(=O)O)OC(=O)C

Isomeric SMILES

CC(C1=CCC2(C1CCCC2Br)C)C(CC(=O)O)OC(=O)C

InChI

InChI=1S/C17H25BrO4/c1-10(14(9-16(20)21)22-11(2)19)12-7-8-17(3)13(12)5-4-6-15(17)18/h7,10,13-15H,4-6,8-9H2,1-3H3,(H,20,21)