octadecan-4-yl (4-hydroxyphenyl)imino-phenyl-methanesulfonate

Systemtic Name: octadecan-4-yl (4-hydroxyphenyl)imino-phenyl-methanesulfonate Openeye Name: 1-propylpentadecyl (4-hydroxyphenyl)imino-phenyl-methanesulfonate CAS Name: (4-hydroxyphenyl)imino-phenylmethanesulfonic acid octadecan-4-yl ester IUPAC Name: octadecan-4-yl (4-hydroxyphenyl)imino-phenylmethanesulfonate Traditional Name: (4-hydroxyphenyl)imino-phenyl-methanesulfonic acid 1-propylpentadecyl ester Formula: C31H47NO4S MolecularWeight: 529.77418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCC)OS(=O)(=O)C(=NC1=CC=C(C=C1)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC(CCC)OS(=O)(=O)C(=NC1=CC=C(C=C1)O)C2=CC=CC=C2

InChI

InChI=1S/C31H47NO4S/c1-3-5-6-7-8-9-10-11-12-13-14-18-22-30(19-4-2)36-37(34,35)31(27-20-16-15-17-21-27)32-28-23-25-29(33)26-24-28/h15-17,20-21,23-26,30,33H,3-14,18-19,22H2,1-2H3