(E)-3-(3-methoxycarbonyl-5-oxidanyl-1-adamantyl)-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-(3-methoxycarbonyl-5-oxidanyl-1-adamantyl)-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-(3-hydroxy-5-methoxycarbonyl-1-adamantyl)-2-methyl-prop-2-enoic acid CAS Name: (E)-3-(3-hydroxy-5-methoxycarbonyl-1-adamantyl)-2-methyl-2-propenoic acid IUPAC Name: (E)-3-(3-hydroxy-5-methoxycarbonyl-1-adamantyl)-2-methylprop-2-enoic acid Traditional Name: (E)-3-(3-carbomethoxy-5-hydroxy-1-adamantyl)-2-methyl-acrylic acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC12CC3CC(C1)(CC(C3)(C2)O)C(=O)OC)C(=O)O

Isomeric SMILES

C/C(=C\C12CC3CC(C1)(CC(C3)(C2)O)C(=O)OC)/C(=O)O

InChI

InChI=1S/C16H22O5/c1-10(12(17)18)3-14-4-11-5-15(7-14,13(19)21-2)9-16(20,6-11)8-14/h3,11,20H,4-9H2,1-2H3,(H,17,18)/b10-3+