(2S)-2-(1-adamantylcarbonylamino)-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-(1-adamantylcarbonylamino)-3-oxidanyl-propanoic acid Openeye Name: (2S)-2-(adamantane-1-carbonylamino)-3-hydroxy-propanoic acid CAS Name: (2S)-2-[[1-adamantyl(oxo)methyl]amino]-3-hydroxypropanoic acid IUPAC Name: (2S)-2-(adamantane-1-carbonylamino)-3-hydroxypropanoic acid Traditional Name: (2S)-2-(adamantane-1-carbonylamino)-3-hydroxy-propionic acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(CO)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N[C@@H](CO)C(=O)O

InChI

InChI=1S/C14H21NO4/c16-7-11(12(17)18)15-13(19)14-4-8-1-9(5-14)3-10(2-8)6-14/h8-11,16H,1-7H2,(H,15,19)(H,17,18)/t8?,9?,10?,11-,14?/m0/s1