2-azanyl-4-ethyl-2-(4-phenoxyphenyl)sulfonyl-nonanoic acid

Systemtic Name: 2-azanyl-4-ethyl-2-(4-phenoxyphenyl)sulfonyl-nonanoic acid Openeye Name: 2-amino-4-ethyl-2-(4-phenoxyphenyl)sulfonyl-nonanoic acid CAS Name: 2-amino-4-ethyl-2-(4-phenoxyphenyl)sulfonylnonanoic acid IUPAC Name: 2-amino-4-ethyl-2-(4-phenoxyphenyl)sulfonylnonanoic acid Traditional Name: 2-amino-4-ethyl-2-(4-phenoxyphenyl)sulfonyl-pelargonic acid Formula: C23H31NO5S MolecularWeight: 433.56094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)CC(C(=O)O)(N)S(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CCCCCC(CC)CC(C(=O)O)(N)S(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C23H31NO5S/c1-3-5-7-10-18(4-2)17-23(24,22(25)26)30(27,28)21-15-13-20(14-16-21)29-19-11-8-6-9-12-19/h6,8-9,11-16,18H,3-5,7,10,17,24H2,1-2H3,(H,25,26)