[1-(2-oxidanylnaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] adamantane-1-carboxylate

Systemtic Name: [1-(2-oxidanylnaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] adamantane-1-carboxylate Openeye Name: [5-(2-hydroxy-1-naphthyl)tetralin-6-yl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [1-(2-hydroxy-1-naphthalenyl)-5,6,7,8-tetrahydronaphthalen-2-yl] ester IUPAC Name: [1-(2-hydroxynaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [5-(2-hydroxy-1-naphthyl)tetralin-6-yl] ester Formula: C31H32O3 MolecularWeight: 452.58398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)OC(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)OC(=O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C31H32O3/c32-26-11-9-22-5-1-3-7-24(22)28(26)29-25-8-4-2-6-23(25)10-12-27(29)34-30(33)31-16-19-13-20(17-31)15-21(14-19)18-31/h1,3,5,7,9-12,19-21,32H,2,4,6,8,13-18H2