N-[2-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethanoylamino]ethyl]-3-chloranyl-adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethanoylamino]ethyl]-3-chloranyl-adamantane-1-carboxamide Openeye Name: N-[2-[[2-(4-tert-butyl-2,6-dimethyl-phenyl)acetyl]amino]ethyl]-3-chloro-adamantane-1-carboxamide CAS Name: N-[2-[[2-(4-tert-butyl-2,6-dimethylphenyl)-1-oxoethyl]amino]ethyl]-3-chloro-1-adamantanecarboxamide IUPAC Name: N-[2-[[2-(4-tert-butyl-2,6-dimethylphenyl)acetyl]amino]ethyl]-3-chloroadamantane-1-carboxamide Traditional Name: N-[2-[[2-(4-tert-butyl-2,6-dimethyl-phenyl)acetyl]amino]ethyl]-3-chloro-adamantane-1-carboxamide Formula: C27H39ClN2O2 MolecularWeight: 459.06376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(=O)NCCNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CC(=O)NCCNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)C)C(C)(C)C

InChI

InChI=1S/C27H39ClN2O2/c1-17-8-21(25(3,4)5)9-18(2)22(17)11-23(31)29-6-7-30-24(32)26-12-19-10-20(13-26)15-27(28,14-19)16-26/h8-9,19-20H,6-7,10-16H2,1-5H3,(H,29,31)(H,30,32)