N-(4-bromanyl-2-methyl-phenyl)-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Formula: C19H24BrNO2 MolecularWeight: 378.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CC23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C19H24BrNO2/c1-12-4-15(20)2-3-16(12)21-17(22)10-18-6-13-5-14(7-18)9-19(23,8-13)11-18/h2-4,13-14,23H,5-11H2,1H3,(H,21,22)/t13-,14+,18?,19?