(5S,7R)-3-[(4-methoxyphenyl)sulfonylamino]adamantane-1-carboxylic acid

Systemtic Name: (5S,7R)-3-[(4-methoxyphenyl)sulfonylamino]adamantane-1-carboxylic acid Openeye Name: (5S,7R)-3-[(4-methoxyphenyl)sulfonylamino]adamantane-1-carboxylic acid CAS Name: (5S,7R)-3-[(4-methoxyphenyl)sulfonylamino]-1-adamantanecarboxylic acid IUPAC Name: (5S,7R)-3-[(4-methoxyphenyl)sulfonylamino]adamantane-1-carboxylic acid Traditional Name: (5S,7R)-3-[(4-methoxyphenyl)sulfonylamino]adamantane-1-carboxylic acid Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC23CC4CC(C2)CC(C4)(C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC23C[C@@H]4C[C@H](C2)CC(C4)(C3)C(=O)O

InChI

InChI=1S/C18H23NO5S/c1-24-14-2-4-15(5-3-14)25(22,23)19-18-9-12-6-13(10-18)8-17(7-12,11-18)16(20)21/h2-5,12-13,19H,6-11H2,1H3,(H,20,21)/t12-,13+,17?,18?