3-heptadecylsulfanyl-N-(4-hydroxyphenyl)-5-pentadecoxy-benzamide

Systemtic Name: 3-heptadecylsulfanyl-N-(4-hydroxyphenyl)-5-pentadecoxy-benzamide Openeye Name: 3-heptadecylsulfanyl-N-(4-hydroxyphenyl)-5-pentadecoxy-benzamide CAS Name: 3-(heptadecylthio)-N-(4-hydroxyphenyl)-5-pentadecoxybenzamide IUPAC Name: 3-heptadecylsulfanyl-N-(4-hydroxyphenyl)-5-pentadecoxybenzamide Traditional Name: 3-(heptadecylthio)-N-(4-hydroxyphenyl)-5-pentadecoxy-benzamide Formula: C45H75NO3S MolecularWeight: 710.1469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCSC1=CC(=CC(=C1)OCCCCCCCCCCCCCCC)C(=O)NC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCSC1=CC(=CC(=C1)OCCCCCCCCCCCCCCC)C(=O)NC2=CC=C(C=C2)O

InChI

InChI=1S/C45H75NO3S/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-36-50-44-38-40(45(48)46-41-31-33-42(47)34-32-41)37-43(39-44)49-35-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h31-34,37-39,47H,3-30,35-36H2,1-2H3,(H,46,48)