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

Systemtic Name: (5S,7R)-3-acetamido-N-(2-chloranyl-4-methyl-phenyl)adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-(2-chloro-4-methyl-phenyl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-(2-chloro-4-methylphenyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-(2-chloro-4-methylphenyl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-(2-chloro-4-methyl-phenyl)adamantane-1-carboxamide Formula: C20H25ClN2O2 MolecularWeight: 360.8777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O2/c1-12-3-4-17(16(21)5-12)22-18(25)19-7-14-6-15(8-19)10-20(9-14,11-19)23-13(2)24/h3-5,14-15H,6-11H2,1-2H3,(H,22,25)(H,23,24)/t14-,15+,19?,20?