(2S)-2-[1-adamantyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid

Systemtic Name: (2S)-2-[1-adamantyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid Openeye Name: (2S)-2-[1-adamantyl(tert-butoxycarbonyl)amino]propanoic acid CAS Name: (2S)-2-[1-adamantyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[1-adamantyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid Traditional Name: (2S)-2-[1-adamantyl(tert-butoxycarbonyl)amino]propionic acid Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C(=O)OC(C)(C)C)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H29NO4/c1-11(15(20)21)19(16(22)23-17(2,3)4)18-8-12-5-13(9-18)7-14(6-12)10-18/h11-14H,5-10H2,1-4H3,(H,20,21)/t11-,12?,13?,14?,18?/m0/s1