1-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclohexane-1-carboxylic acid Openeye Name: 1-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclohexanecarboxylic acid CAS Name: 1-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]cyclohexane-1-carboxylic acid Traditional Name: 1-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclohexanecarboxylic acid Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2(CCCCC2)C(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2(CCCCC2)C(=O)O

InChI

InChI=1S/C18H23NO5S/c1-3-4-14-24-15-8-10-16(11-9-15)25(22,23)19(2)18(17(20)21)12-6-5-7-13-18/h8-11H,5-7,12-14H2,1-2H3,(H,20,21)