methyl (2R)-2-[2-[(5R,7S)-3-phenyl-1-adamantyl]ethanoylamino]propanoate

Systemtic Name: methyl (2R)-2-[2-[(5R,7S)-3-phenyl-1-adamantyl]ethanoylamino]propanoate Openeye Name: methyl (2R)-2-[[2-[(5R,7S)-3-phenyl-1-adamantyl]acetyl]amino]propanoate CAS Name: (2R)-2-[[1-oxo-2-[(5R,7S)-3-phenyl-1-adamantyl]ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(5R,7S)-3-phenyl-1-adamantyl]acetyl]amino]propanoate Traditional Name: (2R)-2-[[2-[(5R,7S)-3-phenyl-1-adamantyl]acetyl]amino]propionic acid methyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)CC12CC3CC(C1)CC(C3)(C2)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)OC)NC(=O)CC12C[C@H]3C[C@@H](C1)CC(C3)(C2)C4=CC=CC=C4

InChI

InChI=1S/C22H29NO3/c1-15(20(25)26-2)23-19(24)13-21-9-16-8-17(10-21)12-22(11-16,14-21)18-6-4-3-5-7-18/h3-7,15-17H,8-14H2,1-2H3,(H,23,24)/t15-,16-,17+,21?,22?/m1/s1