2-[[4-[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(3-chloro-5-ethoxy-4-propoxy-benzoyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[(3-chloro-5-ethoxy-4-propoxyphenyl)-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(3-chloro-5-ethoxy-4-propoxybenzoyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(3-chloro-5-ethoxy-4-propoxy-benzoyl)amino]phenyl]sulfonylamino]acetic acid Formula: C20H23ClN2O7S MolecularWeight: 470.92382

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O)OCC

InChI

InChI=1S/C20H23ClN2O7S/c1-3-9-30-19-16(21)10-13(11-17(19)29-4-2)20(26)23-14-5-7-15(8-6-14)31(27,28)22-12-18(24)25/h5-8,10-11,22H,3-4,9,12H2,1-2H3,(H,23,26)(H,24,25)