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

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclopentane-1-carboxylic acid Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclopentanecarboxylic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]-1-cyclopentanecarboxylic acid IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methylamino]cyclopentane-1-carboxylic acid Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-methyl-amino]cyclopentanecarboxylic acid Formula: C17H21NO5S MolecularWeight: 351.41734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2CCCC2C(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2CCCC2C(=O)O

InChI

InChI=1S/C17H21NO5S/c1-3-4-12-23-13-8-10-14(11-9-13)24(21,22)18(2)16-7-5-6-15(16)17(19)20/h8-11,15-16H,5-7,12H2,1-2H3,(H,19,20)