(1S,3R,5S,7R)-3-azanyl-5-(2-carboxyethyl)adamantane-1-carboxylic acid

Systemtic Name: (1S,3R,5S,7R)-3-azanyl-5-(2-carboxyethyl)adamantane-1-carboxylic acid Openeye Name: (1S,3R,5S,7R)-3-amino-5-(2-carboxyethyl)adamantane-1-carboxylic acid CAS Name: (1S,3R,5S,7R)-3-amino-5-(2-carboxyethyl)-1-adamantanecarboxylic acid IUPAC Name: (1S,3R,5S,7R)-3-amino-5-(2-carboxyethyl)adamantane-1-carboxylic acid Traditional Name: (1S,3R,5S,7R)-3-amino-5-(2-carboxyethyl)adamantane-1-carboxylic acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4/c15-14-5-9-3-12(7-14,2-1-10(16)17)6-13(4-9,8-14)11(18)19/h9H,1-8,15H2,(H,16,17)(H,18,19)/t9-,12+,13+,14-/m1/s1