methyl 2-[[4-[[3-(hexadecanoylamino)phenyl]sulfonylamino]-3-oxidanyl-phenyl]amino]ethanoate

Systemtic Name: methyl 2-[[4-[[3-(hexadecanoylamino)phenyl]sulfonylamino]-3-oxidanyl-phenyl]amino]ethanoate Openeye Name: methyl 2-[4-[[3-(hexadecanoylamino)phenyl]sulfonylamino]-3-hydroxy-anilino]acetate CAS Name: 2-[3-hydroxy-4-[[3-(1-oxohexadecylamino)phenyl]sulfonylamino]anilino]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[3-(hexadecanoylamino)phenyl]sulfonylamino]-3-hydroxyanilino]acetate Traditional Name: 2-[3-hydroxy-4-[(3-palmitamidophenyl)sulfonylamino]anilino]acetic acid methyl ester Formula: C31H47N3O6S MolecularWeight: 589.78638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=C(C=C(C=C2)NCC(=O)OC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=C(C=C(C=C2)NCC(=O)OC)O

InChI

InChI=1S/C31H47N3O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-30(36)33-26-17-16-18-27(22-26)41(38,39)34-28-21-20-25(23-29(28)35)32-24-31(37)40-2/h16-18,20-23,32,34-35H,3-15,19,24H2,1-2H3,(H,33,36)