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

Systemtic Name: (1S,3R,5R,7R)-3-acetamido-5-(carboxymethyl)-7-methyl-adamantane-1-carboxylic acid Openeye Name: (1S,3R,5R,7R)-3-acetamido-5-(carboxymethyl)-7-methyl-adamantane-1-carboxylic acid CAS Name: (1S,3R,5R,7R)-3-acetamido-5-(carboxymethyl)-7-methyl-1-adamantanecarboxylic acid IUPAC Name: (1S,3R,5R,7R)-3-acetamido-5-(carboxymethyl)-7-methyladamantane-1-carboxylic acid Traditional Name: (1S,3R,5R,7R)-3-acetamido-5-(carboxymethyl)-7-methyl-adamantane-1-carboxylic acid Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3(CC(C1)(CC(C3)(C2)C(=O)O)CC(=O)O)C

Isomeric SMILES

CC(=O)N[C@]12C[C@@]3(C[C@](C1)(C[C@@](C3)(C2)C(=O)O)CC(=O)O)C

InChI

InChI=1S/C16H23NO5/c1-10(18)17-16-6-13(2)4-14(8-16,3-11(19)20)7-15(5-13,9-16)12(21)22/h3-9H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)/t13-,14+,15+,16-/m1/s1