phenyl 3-[(4-chlorophenyl)sulfonylamino]-2-ethyl-dodecanoate

Systemtic Name: phenyl 3-[(4-chlorophenyl)sulfonylamino]-2-ethyl-dodecanoate Openeye Name: phenyl 3-[(4-chlorophenyl)sulfonylamino]-2-ethyl-dodecanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]-2-ethyldodecanoic acid phenyl ester IUPAC Name: phenyl 3-[(4-chlorophenyl)sulfonylamino]-2-ethyldodecanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]-2-ethyl-lauric acid phenyl ester Formula: C26H36ClNO4S MolecularWeight: 494.08634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CC)C(=O)OC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCCCC(C(CC)C(=O)OC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C26H36ClNO4S/c1-3-5-6-7-8-9-13-16-25(28-33(30,31)23-19-17-21(27)18-20-23)24(4-2)26(29)32-22-14-11-10-12-15-22/h10-12,14-15,17-20,24-25,28H,3-9,13,16H2,1-2H3