ethyl 3-[[4-[4-[(3-ethoxy-3-oxidanylidene-propyl)amino]phenyl]sulfonylphenyl]amino]propanoate

Systemtic Name: ethyl 3-[[4-[4-[(3-ethoxy-3-oxidanylidene-propyl)amino]phenyl]sulfonylphenyl]amino]propanoate Openeye Name: ethyl 3-[4-[4-[(3-ethoxy-3-oxo-propyl)amino]phenyl]sulfonylanilino]propanoate CAS Name: 3-[4-[4-[(3-ethoxy-3-oxopropyl)amino]phenyl]sulfonylanilino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[4-[(3-ethoxy-3-oxopropyl)amino]phenyl]sulfonylanilino]propanoate Traditional Name: 3-[4-[4-[(3-ethoxy-3-keto-propyl)amino]phenyl]sulfonylanilino]propionic acid ethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NCCC(=O)OCC

Isomeric SMILES

CCOC(=O)CCNC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NCCC(=O)OCC

InChI

InChI=1S/C22H28N2O6S/c1-3-29-21(25)13-15-23-17-5-9-19(10-6-17)31(27,28)20-11-7-18(8-12-20)24-16-14-22(26)30-4-2/h5-12,23-24H,3-4,13-16H2,1-2H3