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

Systemtic Name: (5S,7R)-3-bromanyl-N-(2-chloranyl-4-methyl-phenyl)adamantane-1-carboxamide Openeye Name: (5S,7R)-3-bromo-N-(2-chloro-4-methyl-phenyl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-bromo-N-(2-chloro-4-methylphenyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-bromo-N-(2-chloro-4-methylphenyl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-bromo-N-(2-chloro-4-methyl-phenyl)adamantane-1-carboxamide Formula: C18H21BrClNO MolecularWeight: 382.72244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Br)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br)Cl

InChI

InChI=1S/C18H21BrClNO/c1-11-2-3-15(14(20)4-11)21-16(22)17-6-12-5-13(7-17)9-18(19,8-12)10-17/h2-4,12-13H,5-10H2,1H3,(H,21,22)/t12-,13+,17?,18?