Nom: Compound 1
IUPAC: 3-(4-chlorophenyl)-N-[2-(3,4-dihydroxyphenyl)ethyl]adamantane-1-carboxamide
SMILES:
O=C(NCCc1ccc(O)c(O)c1)C12CC3CC(C1)CC(c1ccc(Cl)cc1)(C3)C2Canonical SMILES:
C1C2CC3(CC1CC(C2)(C3)C(=O)NCCC4=CC(=C(C=C4)O)O)C5=CC=C(C=C5)ClFormule moléculaire: C25H28ClNO3
Masse molaire: 425.90
InChIKey: NEOXEHZXYBCPRQ-UHFFFAOYSA-N
InChI:
PubChem CID: 15983581 →InChI=1S/C25H28ClNO3/c26-20-4-2-19(3-5-20)24-11-17-9-18(12-24)14-25(13-17,15-24)23(30)27-8-7-16-1-6-21(28)22(29)10-16/h1-6,10,17-18,28-29H,7-9,11-15H2,(H,27,30)Synonymes
CHEMBL32870373-(4-chlorophenyl)adamantane-1-carboxylic acid [2-(3,4-dihydroxyphenyl)ethyl]amideSCHEMBL131416orb1741128SCHEMBL29386421NEOXEHZXYBCPRQ-UHFFFAOYSA-NBDBM50017017T68352
Impliqué dans 4 réactions→