2-[[4-[[(E)-tetradec-4-enyl]amino]phenyl]carbonylamino]ethanesulfonic acid

Systemtic Name: 2-[[4-[[(E)-tetradec-4-enyl]amino]phenyl]carbonylamino]ethanesulfonic acid Openeye Name: 2-[[4-[[(E)-tetradec-4-enyl]amino]benzoyl]amino]ethanesulfonic acid CAS Name: 2-[[oxo-[4-[[(E)-tetradec-4-enyl]amino]phenyl]methyl]amino]ethanesulfonic acid IUPAC Name: 2-[[4-[[(E)-tetradec-4-enyl]amino]benzoyl]amino]ethanesulfonic acid Traditional Name: 2-[[4-[[(E)-tetradec-4-enyl]amino]benzoyl]amino]ethanesulfonic acid Formula: C23H38N2O4S MolecularWeight: 438.62382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CCCCNC1=CC=C(C=C1)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

CCCCCCCCC/C=C/CCCNC1=CC=C(C=C1)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C23H38N2O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-24-22-16-14-21(15-17-22)23(26)25-19-20-30(27,28)29/h10-11,14-17,24H,2-9,12-13,18-20H2,1H3,(H,25,26)(H,27,28,29)/b11-10+