(2Z,4E)-5-[7-(1-adamantyl)-6-oxidanyl-naphthalen-2-yl]-3-methyl-penta-2,4-dienoic acid

Systemtic Name: (2Z,4E)-5-[7-(1-adamantyl)-6-oxidanyl-naphthalen-2-yl]-3-methyl-penta-2,4-dienoic acid Openeye Name: (2Z,4E)-5-[7-(1-adamantyl)-6-hydroxy-2-naphthyl]-3-methyl-penta-2,4-dienoic acid CAS Name: (2Z,4E)-5-[7-(1-adamantyl)-6-hydroxy-2-naphthalenyl]-3-methylpenta-2,4-dienoic acid IUPAC Name: (2Z,4E)-5-[7-(1-adamantyl)-6-hydroxynaphthalen-2-yl]-3-methylpenta-2,4-dienoic acid Traditional Name: (2Z,4E)-5-[7-(1-adamantyl)-6-hydroxy-2-naphthyl]-3-methyl-penta-2,4-dienoic acid Formula: C26H28O3 MolecularWeight: 388.49872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C=CC1=CC2=CC(=C(C=C2C=C1)O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C/C(=C/C(=O)O)/C=C/C1=CC2=CC(=C(C=C2C=C1)O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H28O3/c1-16(6-25(28)29)2-3-17-4-5-21-12-24(27)23(11-22(21)10-17)26-13-18-7-19(14-26)9-20(8-18)15-26/h2-6,10-12,18-20,27H,7-9,13-15H2,1H3,(H,28,29)/b3-2+,16-6-