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

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

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

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C19H24BrNO3/c1-23-15-4-3-14(6-16(15)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?


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