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

Systemtic Name: (5S,7R)-3-acetamido-N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[(2,3-dimethoxyphenyl)methyl]-N-methyladamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-methyl-N-o-veratryl-adamantane-1-carboxamide Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)N(C)CC4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)N(C)CC4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C23H32N2O4/c1-15(26)24-23-11-16-8-17(12-23)10-22(9-16,14-23)21(27)25(2)13-18-6-5-7-19(28-3)20(18)29-4/h5-7,16-17H,8-14H2,1-4H3,(H,24,26)/t16-,17+,22?,23?