hexadecyl 4-chloranyl-3-[(4-hydroxyphenyl)sulfonylamino]benzoate

Systemtic Name: hexadecyl 4-chloranyl-3-[(4-hydroxyphenyl)sulfonylamino]benzoate Openeye Name: hexadecyl 4-chloro-3-[(4-hydroxyphenyl)sulfonylamino]benzoate CAS Name: 4-chloro-3-[(4-hydroxyphenyl)sulfonylamino]benzoic acid hexadecyl ester IUPAC Name: hexadecyl 4-chloro-3-[(4-hydroxyphenyl)sulfonylamino]benzoate Traditional Name: 4-chloro-3-[(4-hydroxyphenyl)sulfonylamino]benzoic acid cetyl ester Formula: C29H42ClNO5S MolecularWeight: 552.16548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C29H42ClNO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-36-29(33)24-16-21-27(30)28(23-24)31-37(34,35)26-19-17-25(32)18-20-26/h16-21,23,31-32H,2-15,22H2,1H3