(5S,7R)-3-acetamido-N-[3-[methyl(phenyl)amino]propyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-[3-[methyl(phenyl)amino]propyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[3-(N-methylanilino)propyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[3-(N-methylanilino)propyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[3-(N-methylanilino)propyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-[3-(N-methylanilino)propyl]adamantane-1-carboxamide Formula: C23H33N3O2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)NCCCN(C)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O2/c1-17(27)25-23-14-18-11-19(15-23)13-22(12-18,16-23)21(28)24-9-6-10-26(2)20-7-4-3-5-8-20/h3-5,7-8,18-19H,6,9-16H2,1-2H3,(H,24,28)(H,25,27)/t18-,19+,22?,23?