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

Systemtic Name: methyl (2R)-3-methyl-2-[2-[(5R,7S)-3-phenyl-1-adamantyl]ethanoylamino]butanoate Openeye Name: methyl (2R)-3-methyl-2-[[2-[(5R,7S)-3-phenyl-1-adamantyl]acetyl]amino]butanoate CAS Name: (2R)-3-methyl-2-[[1-oxo-2-[(5R,7S)-3-phenyl-1-adamantyl]ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R)-3-methyl-2-[[2-[(5R,7S)-3-phenyl-1-adamantyl]acetyl]amino]butanoate Traditional Name: (2R)-3-methyl-2-[[2-[(5R,7S)-3-phenyl-1-adamantyl]acetyl]amino]butyric acid methyl ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(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/C24H33NO3/c1-16(2)21(22(27)28-3)25-20(26)14-23-10-17-9-18(11-23)13-24(12-17,15-23)19-7-5-4-6-8-19/h4-8,16-18,21H,9-15H2,1-3H3,(H,25,26)/t17-,18+,21-,23?,24?/m1/s1