(1S,3R,5R,7R)-3-azanyl-5-(carboxymethyl)adamantane-1-carboxylic acid

Systemtic Name: (1S,3R,5R,7R)-3-azanyl-5-(carboxymethyl)adamantane-1-carboxylic acid Openeye Name: (1S,3R,5R,7R)-3-amino-5-(carboxymethyl)adamantane-1-carboxylic acid CAS Name: (1S,3R,5R,7R)-3-amino-5-(carboxymethyl)-1-adamantanecarboxylic acid IUPAC Name: (1S,3R,5R,7R)-3-amino-5-(carboxymethyl)adamantane-1-carboxylic acid Traditional Name: (1S,3R,5R,7R)-3-amino-5-(carboxymethyl)adamantane-1-carboxylic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1(CC(C2)(C3)N)CC(=O)O)C(=O)O

Isomeric SMILES

C1[C@@H]2C[C@@]3(C[C@]1(C[C@](C2)(C3)N)CC(=O)O)C(=O)O

InChI

InChI=1S/C13H19NO4/c14-13-3-8-1-11(6-13,4-9(15)16)5-12(2-8,7-13)10(17)18/h8H,1-7,14H2,(H,15,16)(H,17,18)/t8-,11-,12+,13-/m1/s1