(2R)-2-[2-(1-adamantyl)ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[2-(1-adamantyl)ethanoylamino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[2-(1-adamantyl)acetyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[2-(1-adamantyl)-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[2-(1-adamantyl)acetyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[2-(1-adamantyl)acetyl]amino]-3-phenyl-propionic acid Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)N[C@H](CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C21H27NO3/c23-19(22-18(20(24)25)9-14-4-2-1-3-5-14)13-21-10-15-6-16(11-21)8-17(7-15)12-21/h1-5,15-18H,6-13H2,(H,22,23)(H,24,25)/t15?,16?,17?,18-,21?/m1/s1