(5S,7R)-3-bromanyl-N-(2,4-dimethoxyphenyl)adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-bromanyl-N-(2,4-dimethoxyphenyl)adamantane-1-carboxamide Openeye Name: (5S,7R)-3-bromo-N-(2,4-dimethoxyphenyl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-bromo-N-(2,4-dimethoxyphenyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-bromo-N-(2,4-dimethoxyphenyl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-bromo-N-(2,4-dimethoxyphenyl)adamantane-1-carboxamide Formula: C19H24BrNO3 MolecularWeight: 394.30276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br)OC

InChI

InChI=1S/C19H24BrNO3/c1-23-14-3-4-15(16(6-14)24-2)21-17(22)18-7-12-5-13(8-18)10-19(20,9-12)11-18/h3-4,6,12-13H,5,7-11H2,1-2H3,(H,21,22)/t12-,13+,18?,19?