(5S,7R)-3-acetamido-N-[(2-chlorophenyl)methyl]-N-methyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-[(2-chlorophenyl)methyl]-N-methyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[(2-chlorophenyl)methyl]-N-methyl-adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[(2-chlorophenyl)methyl]-N-methyl-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[(2-chlorophenyl)methyl]-N-methyladamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-(2-chlorobenzyl)-N-methyl-adamantane-1-carboxamide Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)N(C)CC4=CC=CC=C4Cl

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)N(C)CC4=CC=CC=C4Cl

InChI

InChI=1S/C21H27ClN2O2/c1-14(25)23-21-10-15-7-16(11-21)9-20(8-15,13-21)19(26)24(2)12-17-5-3-4-6-18(17)22/h3-6,15-16H,7-13H2,1-2H3,(H,23,25)/t15-,16+,20?,21?