(2-methoxyphenyl)methyl (5S,7R)-3-bromanyladamantane-1-carboxylate

Systemtic Name: (2-methoxyphenyl)methyl (5S,7R)-3-bromanyladamantane-1-carboxylate Openeye Name: (2-methoxyphenyl)methyl (5S,7R)-3-bromoadamantane-1-carboxylate CAS Name: (5S,7R)-3-bromo-1-adamantanecarboxylic acid (2-methoxyphenyl)methyl ester IUPAC Name: (2-methoxyphenyl)methyl (5S,7R)-3-bromoadamantane-1-carboxylate Traditional Name: (5S,7R)-3-bromoadamantane-1-carboxylic acid o-anisyl ester Formula: C19H23BrO3 MolecularWeight: 379.28812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COC(=O)C23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

COC1=CC=CC=C1COC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br

InChI

InChI=1S/C19H23BrO3/c1-22-16-5-3-2-4-15(16)11-23-17(21)18-7-13-6-14(8-18)10-19(20,9-13)12-18/h2-5,13-14H,6-12H2,1H3/t13-,14+,18?,19?